IGOR WAVES/D fit_wave3 fit_fit_wave3 fit_wave8 fit_wave13 fit_Isolong203counts fit_Isolong204counts fit_mz146_off BEGIN -2.748523988106719 -2.748523988106719 -3.020002737929978 2.934514486957895 96.83544334833186 40.32989817891848 522.1082440181153 12.24155727782939 12.24155727782939 12.40759199701785 14.17418490303044 2048.917107860453 703.11565441149 14048.21508601448 END X SetScale/P x 0.752,0.234,"", fit_wave3; SetScale y 0,0,"", fit_wave3 X Note fit_wave3, "fit_wave3= W_coef[0]+W_coef[1]*x\rW_coef={-50.922,64.06}\rV_chisq= 159.328;V_npnts= 11;V_numNaNs= 0;V_numINFs= 0;\rV_startRow= 0;V_endRow= 10;V_q= 1;V_Rab= -0.997785;\r\rV_Pr= 0.716873;V_r2= 0.513907;\rW_sigma={19.1,20.8}" X Note fit_wave3, "\rCoefficient values ± one standard deviation\r\ta\t=-50.922 ± 19.1\r\tb\t=64.06 ± 20.8\r" X SetScale/P x 0.752,0.234,"", fit_fit_wave3; SetScale y 0,0,"", fit_fit_wave3 X Note fit_fit_wave3, "fit_fit_wave3= W_coef[0]+W_coef[1]*x\rW_coef={-50.922,64.06}\rV_chisq= 0;V_npnts= 2;V_numNaNs= 0;V_numINFs= 0;V_startRow= 0;\r\rV_endRow= 1;V_q= 1;V_Rab= -0.991058;V_Pr= 1;V_r2= 1;\rW_sigma={NaN,NaN}\r\rCoefficient values ± one standard deviation" X Note fit_fit_wave3, "\ta\t=-50.922 ± -1.#J\r\tb\t=64.06 ± -1.#J\r" X SetScale/P x 0.752,0.24,"", fit_wave8; SetScale y 0,0,"", fit_wave8 X Note fit_wave8, "fit_wave8= W_coef[0]+W_coef[1]*x\rW_coef={-51.36,64.282}\rV_chisq= 156.992;V_npnts= 11;V_numNaNs= 0;V_numINFs= 0;\rV_startRow= 0;V_endRow= 10;V_q= 1;V_Rab= -0.997715;\r\rV_Pr= 0.726368;V_r2= 0.52761;\rW_sigma={18.6,20.3}" X Note fit_wave8, "\rCoefficient values ± one standard deviation\r\ta\t=-51.36 ± 18.6\r\tb\t=64.282 ± 20.3\r" X SetScale/P x 0.89,0.102,"", fit_wave13; SetScale y 0,0,"", fit_wave13 X Note fit_wave13, "fit_wave13= W_coef[0]+W_coef[1]*x\rW_coef={-95.137,110.19}\rV_chisq= 68.5261;V_npnts= 9;V_numNaNs= 2;V_numINFs= 0;\rV_startRow= 0;V_endRow= 10;V_q= 1;V_Rab= -0.999439;\r\rV_Pr= 0.782753;V_r2= 0.612703;\rW_sigma={31.1,33.1}" X Note fit_wave13, "\rCoefficient values ± one standard deviation\r\ta\t=-95.137 ± 31.1\r\tb\t=110.19 ± 33.1\r" X SetScale/P x 0,208.7685261,"", fit_Isolong203counts; SetScale y 0,0,"", fit_Isolong203counts X Note fit_Isolong203counts, "fit_Isolong203counts= W_coef[0]+W_coef[1]*x\rW_coef={96.835,9.3505}\rV_chisq= 669.33;V_npnts= 5;V_numNaNs= 0;V_numINFs= 0;\r\rV_startRow= 0;V_endRow= 4;V_q= 1;V_Rab= -0.816497;V_Pr= 0.99986;\rW_sigma={11.6,0.0905}" X Note fit_Isolong203counts, "\rCoefficient values ± one standard deviation\r\ta\t=96.835 ± 11.6\r\tb\t=9.3505 ± 0.0905\r" X SetScale/P x 0,208.7685261,"", fit_Isolong204counts; SetScale y 0,0,"", fit_Isolong204counts X Note fit_Isolong204counts, "fit_Isolong204counts= W_coef[0]+W_coef[1]*x\rW_coef={40.33,3.1747}\rV_chisq= 95.9606;V_npnts= 5;V_numNaNs= 0;V_numINFs= 0;\r\rV_startRow= 0;V_endRow= 4;V_q= 1;V_Rab= -0.816497;V_Pr= 0.999825;\rW_sigma={4.38,0.0343}" X Note fit_Isolong204counts, "\rCoefficient values ± one standard deviation\r\ta\t=40.33 ± 4.38\r\tb\t=3.1747 ± 0.0343\r" X SetScale/P x 0,599.2572077,"", fit_mz146_off; SetScale y 0,0,"", fit_mz146_off X Note fit_mz146_off, "fit_mz146_off= W_coef[0]+W_coef[1]*x\rW_coef={522.11,22.571}\rV_chisq= 79124.1;V_npnts= 4;V_numNaNs= 0;V_numINFs= 0;\rV_startRow= 0;V_endRow= 3;V_q= 1;V_Rab= -0.835629;V_Pr= 0.999605;\r\rV_r2= 0.99921;\rW_sigma={181,0.449}" X Note fit_mz146_off, "\rCoefficient values ± one standard deviation\r\ta\t=522.11 ± 181\r\tb\t=22.571 ± 0.449\r" WAVES/D isorh BEGIN NAN END X SetScale/P x 0,1,"", isorh; SetScale y 0,0,"", isorh WAVES/D isoSH isoSHdev apineneSH apineneSHdev bpineneSH bpineneSHdev LimoneneSH limoneneSHdev myrceneSH myrceneSHdev ocimeneSH ocimeneSHdev FarneseneSH farneseneSHdev IsolongSH IsolongSHdev humuleneSH humuleneSHdev caryophSH caryophSHdev isolong236 isolong236std sumapinene sumapineneerr sumlimonene sumlimoneneerr sumocimene sumocimeneerr summyrcene sumyrceneerr sumbpinene sumpineneerr 'isolong 236 stdev' BEGIN 0 0.017327 0 0.017327 0 0.017327 0 0.017327 0 0.017327 0 0.017327 0 0.017327 0 0.017327 0 0.017327 0 0.017327 1.179686385 0.251536458 24.87966737 2.6955514 16.4038925 3.725851417 14.8715279 1.400087677 6.070618091 0.460972801 15.52834767 1.929639273 0.151576308 2.07924 0.300112443 2.021483333 0.264674297 1.761578333 0.132337148 1.7327 0.17327 1.790456667 0.100037481 1.842437667 0.16099509 1.802008 0.14702447 1.830886333 0.09852549300000001 1.802008 0.138616 1.830886333 0.115368851 0.302011678 0.166799195 22.08785056 2.331513322 17.00537008 3.919844982 14.17212465 0.765246336 8.398965603000001 1.125859351 16.04841938 1.907936398 0.066602592 3.4654 0.17327 3.580913333 0.100037481 3.546259333 0.087210654 3.523156667 0.264674297 3.598240333 0.16099509 3.505829667 0.13897651 3.500054 0.130048725 3.627118667 0.052934859 3.505829667 0.104442197 3.528932333 0.144276107 0.200708109 0 21.67353192 1.177367779 16.05547136 3.731316706 13.83743568 1.225821678 10.6119718 1.121399012 17.42710738 1.762684855 0.038418715 6.988556667 0.100037481 6.873043333 0.100037481 6.959678333 0.09852549300000001 7.005883667 0.088915258 6.959678333 0.132337148 7.017435 0.086635 7.034762 0.10820708 6.849940667 0.112736516 7.138724 0.187420161 7.017435 0.086635 0.148174517 0 17.89486173 0.231585196 13.67220754 3.502995374 13.18661186 0.657348426 11.52892142 1.150238303 18.36787964 1.749591067 0.015556299 10.36732167 0.132337148 10.41930267 0.040014992 10.45395667 0.131197927 10.482835 0.086635 10.482835 0.229214665 10.448181 0.105396026 10.361546 0.049008157 10.45973233 0.122928115 10.500162 0.113620737 10.430854 0.09647265300000001 0.143701729 0 16.97880173 0.642019236 11.22562416 3.031171945 13.33513299 0.82429162 11.03652988 1.244348107 15.35934658 1.323543913 0.01573371 13.948235 0.122520392 13.8616 0.17327 14.000216 0.124946774 13.80384333 0.100037481 13.90780533 0.111397024 13.89047833 0.180345134 14.017543 0.122520392 13.948235 0.121289 14.06374833 0.144276107 13.98866467 0.111397024 0.11930297 0 17.05392434 2.062318166 7.756238199 2.125299493 13.53092602 1.662520611 11.46178687 1.178095854 16.3561036 2.096519522 0.031127165 END X SetScale/P x 0,1,"", isoSH; SetScale y 0,0,"", isoSH X SetScale/P x 0,1,"", isoSHdev; SetScale y 0,0,"", isoSHdev X SetScale/P x 0,1,"", apineneSH; SetScale y 0,0,"", apineneSH X SetScale/P x 0,1,"", apineneSHdev; SetScale y 0,0,"", apineneSHdev X SetScale/P x 0,1,"", bpineneSH; SetScale y 0,0,"", bpineneSH X SetScale/P x 0,1,"", bpineneSHdev; SetScale y 0,0,"", bpineneSHdev X SetScale/P x 0,1,"", LimoneneSH; SetScale y 0,0,"", LimoneneSH X SetScale/P x 0,1,"", limoneneSHdev; SetScale y 0,0,"", limoneneSHdev X SetScale/P x 0,1,"", myrceneSH; SetScale y 0,0,"", myrceneSH X SetScale/P x 0,1,"", myrceneSHdev; SetScale y 0,0,"", myrceneSHdev X SetScale/P x 0,1,"", ocimeneSH; SetScale y 0,0,"", ocimeneSH X SetScale/P x 0,1,"", ocimeneSHdev; SetScale y 0,0,"", ocimeneSHdev X SetScale/P x 0,1,"", FarneseneSH; SetScale y 0,0,"", FarneseneSH X SetScale/P x 0,1,"", farneseneSHdev; SetScale y 0,0,"", farneseneSHdev X SetScale/P x 0,1,"", IsolongSH; SetScale y 0,0,"", IsolongSH X SetScale/P x 0,1,"", IsolongSHdev; SetScale y 0,0,"", IsolongSHdev X SetScale/P x 0,1,"", humuleneSH; SetScale y 0,0,"", humuleneSH X SetScale/P x 0,1,"", humuleneSHdev; SetScale y 0,0,"", humuleneSHdev X SetScale/P x 0,1,"", caryophSH; SetScale y 0,0,"", caryophSH X SetScale/P x 0,1,"", caryophSHdev; SetScale y 0,0,"", caryophSHdev X SetScale/P x 0,1,"", isolong236; SetScale y 0,0,"", isolong236 X SetScale/P x 0,1,"", isolong236std; SetScale y 0,0,"", isolong236std X SetScale/P x 0,1,"", sumapinene; SetScale y 0,0,"", sumapinene X SetScale/P x 0,1,"", sumapineneerr; SetScale y 0,0,"", sumapineneerr X SetScale/P x 0,1,"", sumlimonene; SetScale y 0,0,"", sumlimonene X SetScale/P x 0,1,"", sumlimoneneerr; SetScale y 0,0,"", sumlimoneneerr X SetScale/P x 0,1,"", sumocimene; SetScale y 0,0,"", sumocimene X SetScale/P x 0,1,"", sumocimeneerr; SetScale y 0,0,"", sumocimeneerr X SetScale/P x 0,1,"", summyrcene; SetScale y 0,0,"", summyrcene X SetScale/P x 0,1,"", sumyrceneerr; SetScale y 0,0,"", sumyrceneerr X SetScale/P x 0,1,"", sumbpinene; SetScale y 0,0,"", sumbpinene X SetScale/P x 0,1,"", sumpineneerr; SetScale y 0,0,"", sumpineneerr X SetScale/P x 0,1,"", 'isolong 236 stdev'; SetScale y 0,0,"", 'isolong 236 stdev' WAVES/D Isolong203counts Isolong204counts pptisolong Isolong236counts BEGIN 2034.475106 697.0765407 208.7685261 27.08849983 1579.784117 544.6384888 156.5763946 14.89575525 1070.47255 373.3219429 104.3842631 10.54757611 590.769044 205.3266391 52.19213153 4.45411332 88.88056177 38.25027023 0 0 END X SetScale/P x 0,1,"", Isolong203counts; SetScale y 0,0,"", Isolong203counts X SetScale/P x 0,1,"", Isolong204counts; SetScale y 0,0,"", Isolong204counts X SetScale/P x 0,1,"", pptisolong; SetScale y 0,0,"", pptisolong X SetScale/P x 0,1,"", Isolong236counts; SetScale y 0,0,"", Isolong236counts WAVES/D 'a-pinene vs o2' 'b-pinene vs o2' BEGIN 21.10279775 21.61297623 19.70708991 19.33923162 19.28664044 18.59697871 END X SetScale/P x 0,1,"", 'a-pinene vs o2'; SetScale y 0,0,"", 'a-pinene vs o2' X SetScale/P x 0,1,"", 'b-pinene vs o2'; SetScale y 0,0,"", 'b-pinene vs o2' WAVES/D 'myrcene vs o2' 'ocimene vs o2' 'limonene vs o2' 'gamma-terp' 'b-car vs o2' 'farn vs o2' 'a-hum vs o2' 'isolong vs o2' 'fraction O2' BEGIN 16.68021942 13.51931786 12.70075476 6.987674257 9.305312576 9.118662027999999 11.90723212 16.95400417 0 7.548188876 11.92502743 6.160315514 3.596571609 6.414036989 5.555562375 7.159823095 6.578930965 0.08 6.669462575 11.55600562 4.420138254 3.414468861 5.360110766 4.884526945 6.710741085 4.438323505 0.2 END X SetScale/P x 0,1,"", 'myrcene vs o2'; SetScale y 0,0,"", 'myrcene vs o2' X SetScale/P x 0,1,"", 'ocimene vs o2'; SetScale y 0,0,"", 'ocimene vs o2' X SetScale/P x 0,1,"", 'limonene vs o2'; SetScale y 0,0,"", 'limonene vs o2' X SetScale/P x 0,1,"", 'gamma-terp'; SetScale y 0,0,"", 'gamma-terp' X SetScale/P x 0,1,"", 'b-car vs o2'; SetScale y 0,0,"", 'b-car vs o2' X SetScale/P x 0,1,"", 'farn vs o2'; SetScale y 0,0,"", 'farn vs o2' X SetScale/P x 0,1,"", 'a-hum vs o2'; SetScale y 0,0,"", 'a-hum vs o2' X SetScale/P x 0,1,"", 'isolong vs o2'; SetScale y 0,0,"", 'isolong vs o2' X SetScale/P x 0,1,"", 'fraction O2'; SetScale y 0,0,"", 'fraction O2' WAVES/D 'f O2 isoprene' 'Isoprene vs O2' BEGIN 0 14.44899479 0.01 14.26163199 0.04 8.359637106999999 0.08 5.62470835 0.12 4.649245083 0.16 3.915969462 0.2 3.7 END X SetScale/P x 0,1,"", 'f O2 isoprene'; SetScale y 0,0,"", 'f O2 isoprene' X SetScale/P x 0,1,"", 'Isoprene vs O2'; SetScale y 0,0,"", 'Isoprene vs O2' WAVES/D 'isoprene f O2' BEGIN 0 0.01 0.04 0.12 0.16 0.2 END X SetScale/P x 0,1,"", 'isoprene f O2'; SetScale y 0,0,"", 'isoprene f O2' WAVES/D 'ppm benz' 'isoprene vs benz' 'a-pine vs benz' 'myrcene vs benz' 'ocimene vs benz' 'limonen vs benz' 'b-car vs benz' 'farn vs benz' 'a-hum vs benz' 'isolong vs benz' BEGIN 360 5.053078089 12.93958698 NAN NAN NAN NAN NAN NAN NAN 300 5.070102034 13.5147958 7.120149352 11.47038519 3.62 8.921024331 15.44651073 10.53838359 5.62617907 240 4.58410886 NAN 6.843864106 9.954580757 NAN 8.389742343 14.90013579 11.05423512 5.708970673 180 5.17723863 13.66550667 6.688591669 10.31213449 3.85 8.581878807000001 16.04552791 10.40967455 5.855038925 120 3.847890194 NAN 6.805407174 11.13395096 NAN 9.048587738 16.13171345 10.9101138 5.840398183 60 1.62155 14.12687746 7.034717433 11.19592209 4.34 9.224911407 16.44479059 11.67750246 6.118399039 30 0.959842153 NAN NAN NAN NAN NAN NAN NAN NAN 15 NAN NAN NAN NAN NAN NAN NAN NAN NAN END X SetScale/P x 0,1,"", 'ppm benz'; SetScale y 0,0,"", 'ppm benz' X SetScale/P x 0,1,"", 'isoprene vs benz'; SetScale y 0,0,"", 'isoprene vs benz' X SetScale/P x 0,1,"", 'a-pine vs benz'; SetScale y 0,0,"", 'a-pine vs benz' X SetScale/P x 0,1,"", 'myrcene vs benz'; SetScale y 0,0,"", 'myrcene vs benz' X SetScale/P x 0,1,"", 'ocimene vs benz'; SetScale y 0,0,"", 'ocimene vs benz' X SetScale/P x 0,1,"", 'limonen vs benz'; SetScale y 0,0,"", 'limonen vs benz' X SetScale/P x 0,1,"", 'b-car vs benz'; SetScale y 0,0,"", 'b-car vs benz' X SetScale/P x 0,1,"", 'farn vs benz'; SetScale y 0,0,"", 'farn vs benz' X SetScale/P x 0,1,"", 'a-hum vs benz'; SetScale y 0,0,"", 'a-hum vs benz' X SetScale/P x 0,1,"", 'isolong vs benz'; SetScale y 0,0,"", 'isolong vs benz' WAVES/D 'b-pine vs benz' BEGIN NAN 14.0901358 13.69036697 14.29041734 15.1935 13.11500444 NAN NAN NAN NAN NAN NAN END X SetScale/P x 0,1,"", 'b-pine vs benz'; SetScale y 0,0,"", 'b-pine vs benz' WAVES/D conc counts 'limn 20_O2 mz 135' 'limn 20_O2 mz 136' 'limn 20_O2 mz 168' 'limn 0_O2 mz 135' 'limn 0_O2 mz 136' 'limn 0_O2 mz 1368' BEGIN 540 3754.64404296875 1799.10304548732 2846.46100795511 4388.0873720858 78.2691143379473 8600.39053798114 54.9104722735704 405 2987.0283203125 1419.87716738339 2289.13543506896 3537.36763959999 43.6797222719345 6960.10412134579 42.7136820776594 270 1901.68420410156 1041.64418432203 1649.22238106315 2553.62224953005 22.555328051974 5260.77072830966 31.1354621555342 135 961.001403808594 629.345738363967 1026.6052991558 1547.39335178498 8.166413884310639 3373.75050187697 12.8498931083262 0 108.424949645996 254.59454191696 426.806249709708 630.78930544857 -9.412425395160231 1688.37949688716 2.03429835158706 END X SetScale/P x 0,1,"", conc; SetScale y 0,0,"", conc X SetScale/P x 0,1,"", counts; SetScale y 0,0,"", counts X SetScale/P x 0,1,"", 'limn 20_O2 mz 135'; SetScale y 0,0,"", 'limn 20_O2 mz 135' X SetScale/P x 0,1,"", 'limn 20_O2 mz 136'; SetScale y 0,0,"", 'limn 20_O2 mz 136' X SetScale/P x 0,1,"", 'limn 20_O2 mz 168'; SetScale y 0,0,"", 'limn 20_O2 mz 168' X SetScale/P x 0,1,"", 'limn 0_O2 mz 135'; SetScale y 0,0,"", 'limn 0_O2 mz 135' X SetScale/P x 0,1,"", 'limn 0_O2 mz 136'; SetScale y 0,0,"", 'limn 0_O2 mz 136' X SetScale/P x 0,1,"", 'limn 0_O2 mz 1368'; SetScale y 0,0,"", 'limn 0_O2 mz 1368' WAVES/D fit_counts 'fit_iso 80RH m/z 146' 'fit_iso 80 rh m/z 73' BEGIN 78.86356353759729 58.79211206254595 7670.093820098751 3806.249604797363 1651.654591998795 10706.71894001819 END X SetScale/P x 0,540,"", fit_counts; SetScale y 0,0,"", fit_counts X Note fit_counts, "fit_counts= W_coef[0]+W_coef[1]*x\rW_coef={78.864,6.9026}\rV_chisq= 20363;V_npnts= 5;V_numNaNs= 0;V_numINFs= 0;\rV_startRow= 0;V_endRow= 4;V_q= 1;V_Rab= -0.816497;V_Pr= 0.99883;\r\rV_r2= 0.99766;\rW_sigma={63.8,0.193}" X Note fit_counts, "\rCoefficient values ± one standard deviation\r\ta\t=78.864 ± 63.8\r\tb\t=6.9026 ± 0.193\r" X SetScale/P x 0,519.3494777,"", 'fit_iso 80RH m/z 146'; SetScale y 0,0,"", 'fit_iso 80RH m/z 146' X Note 'fit_iso 80RH m/z 146', "'fit_iso 80RH m/z 146'= W_coef[0]+W_coef[1]*x\rW_coef={58.792,3.067}\rV_chisq= 401.152;V_npnts= 5;V_numNaNs= 0;V_numINFs= 0;\r\rV_startRow= 0;V_endRow= 4;V_q= 1;V_Rab= -0.816497;V_Pr= 0.999874;\rW_sigma={8.96,0.0282}" X Note 'fit_iso 80RH m/z 146', "\rCoefficient values ± one standard deviation\r\ta\t=58.792 ± 8.96\r\tb\t=3.067 ± 0.0282\r" X SetScale/P x 0,519.3494777,"", 'fit_iso 80 rh m/z 73'; SetScale y 0,0,"", 'fit_iso 80 rh m/z 73' X Note 'fit_iso 80 rh m/z 73', "'fit_iso 80 rh m/z 73'= W_coef[0]+W_coef[1]*x\rW_coef={7670.1,5.847}\rV_chisq= 145820;V_npnts= 5;V_numNaNs= 0;V_numINFs= 0;\r\rV_startRow= 0;V_endRow= 4;V_q= 1;V_Rab= -0.816497;V_Pr= 0.987584;\rW_sigma={171,0.537}" X Note 'fit_iso 80 rh m/z 73', "\rCoefficient values ± one standard deviation\r\ta\t=7670.1 ± 171\r\tb\t=5.847 ± 0.537\r" WAVES/D farn_204 farn_203 farn_236 farn_204_stdv farn_203_stdv farn_236_stdv isolong_204 isolong_203 isolong_236 isolong_204_stdv isolong_203_stdv isolong_236_stdv apine_136 apine_135 apine_168 apine_136_stdv apine_135_stdv apine_168_stdv BEGIN 7.753070418 1.310820775 1.548973364 1.140173327 0.211080331 0.280552789 3.141286965 7.700054353 1.179686385 0.465540036 1.436712106 0.151576308 21.15517449 0.5627673989999999 0.308911775 2.668015516 0.038065424 0.034595885 8.09574375 1.246006206 1.545008335 0.02251911 0.000218583 0.01666572 3.304146798 8.857224904000001 0.302011678 0.571087849 2.447063668 0.066602592 19.11367518 0.260799684 0.267121246 2.303561917 0.041537837 0.042443451 7.987528445 1.274783749 1.520382542 0.645677311 0.177350313 0.139571634 3.253964358 8.829114205 0.200708109 0.771375612 2.739235258 0.038418715 18.71447343 0.268485561 0.264358099 1.15826726 0.063833554 0.034457709 7.826976413 1.129482803 1.484121236 1.305465474 0.119888456 0.274476257 3.382404449 8.794761627 0.148174517 0.381646611 1.117286604 0.015556299 15.47303583 0.185298814 0.221533729 0.075220017 0.067081477 0.034413222 8.262612921000001 1.059916919 1.527218284 0.168061878 0.025918667 0.043306752 3.231217518 8.92393139 0.143701729 0.331701384 1.179939221 0.01573371 14.66039884 0.185561507 0.192052185 0.62791618 0.01304841 0.041151375 7.628295392 1.0025267 1.414952478 0.424455139 0.06024078 0.084922226 2.943298272 8.550539928999999 0.11930297 0.302422228 1.089942152 0.031127165 14.78703907 0.237577392 0.136450661 2.039223148 0.17053826 0.02885872 END X SetScale/P x 0,1,"", farn_204; SetScale y 0,0,"", farn_204 X SetScale/P x 0,1,"", farn_203; SetScale y 0,0,"", farn_203 X SetScale/P x 0,1,"", farn_236; SetScale y 0,0,"", farn_236 X SetScale/P x 0,1,"", farn_204_stdv; SetScale y 0,0,"", farn_204_stdv X SetScale/P x 0,1,"", farn_203_stdv; SetScale y 0,0,"", farn_203_stdv X SetScale/P x 0,1,"", farn_236_stdv; SetScale y 0,0,"", farn_236_stdv X SetScale/P x 0,1,"", isolong_204; SetScale y 0,0,"", isolong_204 X SetScale/P x 0,1,"", isolong_203; SetScale y 0,0,"", isolong_203 X SetScale/P x 0,1,"", isolong_236; SetScale y 0,0,"", isolong_236 X SetScale/P x 0,1,"", isolong_204_stdv; SetScale y 0,0,"", isolong_204_stdv X SetScale/P x 0,1,"", isolong_203_stdv; SetScale y 0,0,"", isolong_203_stdv X SetScale/P x 0,1,"", isolong_236_stdv; SetScale y 0,0,"", isolong_236_stdv X SetScale/P x 0,1,"", apine_136; SetScale y 0,0,"", apine_136 X SetScale/P x 0,1,"", apine_135; SetScale y 0,0,"", apine_135 X SetScale/P x 0,1,"", apine_168; SetScale y 0,0,"", apine_168 X SetScale/P x 0,1,"", apine_136_stdv; SetScale y 0,0,"", apine_136_stdv X SetScale/P x 0,1,"", apine_135_stdv; SetScale y 0,0,"", apine_135_stdv X SetScale/P x 0,1,"", apine_168_stdv; SetScale y 0,0,"", apine_168_stdv WAVES/D 'isoprene vs benz norm' 'a-pine vs benz norm' 'myrcene vs benz norm' 'ocimene vs benz norm' 'limonene vs benz norm' 'bcar vs benz norm' 'farn vs benz norm' 'ahum vs benz norm' 'isolong vs benz norm' 'bpine vs benz norm' BEGIN 0.996643064 0.957439252 NAN NAN NAN NAN NAN NAN NAN NAN 1 1 1 1 1 1 1 1 1 1 0.904145875 NAN 0.961196042 0.867849421 NAN 0.940446272 0.964626291 1.048944811 1.014715135 0.9716325649999999 1.021131733 1.011150738 0.939388917 0.8990183430000001 1.063535912 0.961984168 1.038779011 0.98778752 1.040677689 1.014215655 0.758937694 NAN 0.955795875 0.9706723390000001 NAN 1.014299934 1.044359564 1.035271009 1.038075568 1.078310303 0.319826039 1.045291088 0.988001657 0.976068838 1.198895028 1.03406449 1.064629528 1.108090412 1.087487425 0.930795381 0.189314215 NAN NAN NAN NAN NAN NAN NAN NAN NAN END X SetScale/P x 0,1,"", 'isoprene vs benz norm'; SetScale y 0,0,"", 'isoprene vs benz norm' X SetScale/P x 0,1,"", 'a-pine vs benz norm'; SetScale y 0,0,"", 'a-pine vs benz norm' X SetScale/P x 0,1,"", 'myrcene vs benz norm'; SetScale y 0,0,"", 'myrcene vs benz norm' X SetScale/P x 0,1,"", 'ocimene vs benz norm'; SetScale y 0,0,"", 'ocimene vs benz norm' X SetScale/P x 0,1,"", 'limonene vs benz norm'; SetScale y 0,0,"", 'limonene vs benz norm' X SetScale/P x 0,1,"", 'bcar vs benz norm'; SetScale y 0,0,"", 'bcar vs benz norm' X SetScale/P x 0,1,"", 'farn vs benz norm'; SetScale y 0,0,"", 'farn vs benz norm' X SetScale/P x 0,1,"", 'ahum vs benz norm'; SetScale y 0,0,"", 'ahum vs benz norm' X SetScale/P x 0,1,"", 'isolong vs benz norm'; SetScale y 0,0,"", 'isolong vs benz norm' X SetScale/P x 0,1,"", 'bpine vs benz norm'; SetScale y 0,0,"", 'bpine vs benz norm' WAVES/D 'limonene vs benz norm1' 'ppm benz' 'a-pine vs benz norm1' BEGIN 1 300 1 1.063535912 180 1.011150738 1.198895028 60 1.045291088 END X SetScale/P x 0,1,"", 'limonene vs benz norm1'; SetScale y 0,0,"", 'limonene vs benz norm1' X SetScale/P x 0,1,"", 'ppm benz'; SetScale y 0,0,"", 'ppm benz' X SetScale/P x 0,1,"", 'a-pine vs benz norm1'; SetScale y 0,0,"", 'a-pine vs benz norm1' WAVES/D 'fit_limn 20_O2 mz 168' 'fit_limn 20_O2 mz 136' 'fit_limn 20_O2 mz 135' 'fit_limn 0_O2 mz 136' 'fit_limn 0_O2 mz 1368' 'fit_limn 0_O2 mz 135' BEGIN 630.5378993231025 427.2781440163329 253.003248204996 1694.603936681503 1.605534228388859 -13.52364694178629 4432.36606746446 2868.014004784575 1804.822622542751 8658.75421679401 55.85198894983234 70.82690818904986 END X SetScale/P x 0,333.8353891,"", 'fit_limn 20_O2 mz 168'; SetScale y 0,0,"", 'fit_limn 20_O2 mz 168' X Note 'fit_limn 20_O2 mz 168', "'fit_limn 20_O2 mz 168'= W_coef[0]+W_coef[1]*x\rW_coef={630.54,11.388}\rV_chisq= 6656.91;V_npnts= 5;V_numNaNs= 0;V_numINFs= 0;\r\rV_startRow= 0;V_endRow= 4;V_q= 1;V_Rab= -0.816497;V_Pr= 0.999632;\rW_sigma={36.5,0.178}" X Note 'fit_limn 20_O2 mz 168', "\rCoefficient values ± one standard deviation\r\ta\t=630.54 ± 36.5\r\tb\t=11.388 ± 0.178\r" X SetScale/P x 0,333.8353891,"", 'fit_limn 20_O2 mz 136'; SetScale y 0,0,"", 'fit_limn 20_O2 mz 136' X Note 'fit_limn 20_O2 mz 136', "'fit_limn 20_O2 mz 136'= W_coef[0]+W_coef[1]*x\rW_coef={427.28,7.3112}\rV_chisq= 1565.14;V_npnts= 5;V_numNaNs= 0;V_numINFs= 0;\r\rV_startRow= 0;V_endRow= 4;V_q= 1;V_Rab= -0.816497;V_Pr= 0.99979;\rW_sigma={17.7,0.0865}" X Note 'fit_limn 20_O2 mz 136', "\rCoefficient values ± one standard deviation\r\ta\t=427.28 ± 17.7\r\tb\t=7.3112 ± 0.0865\r" X SetScale/P x 0,333.8353891,"", 'fit_limn 20_O2 mz 135'; SetScale y 0,0,"", 'fit_limn 20_O2 mz 135' X Note 'fit_limn 20_O2 mz 135', "'fit_limn 20_O2 mz 135'= W_coef[0]+W_coef[1]*x\rW_coef={253,4.6485}\rV_chisq= 341.234;V_npnts= 5;V_numNaNs= 0;V_numINFs= 0;\r\rV_startRow= 0;V_endRow= 4;V_q= 1;V_Rab= -0.816497;V_Pr= 0.999887;\rW_sigma={8.26,0.0404}" X Note 'fit_limn 20_O2 mz 135', "\rCoefficient values ± one standard deviation\r\ta\t=253 ± 8.26\r\tb\t=4.6485 ± 0.0404\r" X SetScale/P x 0,333.8353891,"", 'fit_limn 0_O2 mz 136'; SetScale y 0,0,"", 'fit_limn 0_O2 mz 136' X Note 'fit_limn 0_O2 mz 136', "'fit_limn 0_O2 mz 136'= W_coef[0]+W_coef[1]*x\rW_coef={1694.6,20.861}\rV_chisq= 16143.7;V_npnts= 5;V_numNaNs= 0;V_numINFs= 0;\r\rV_startRow= 0;V_endRow= 4;V_q= 1;V_Rab= -0.816497;V_Pr= 0.999734;\rW_sigma={56.8,0.278}" X Note 'fit_limn 0_O2 mz 136', "\rCoefficient values ± one standard deviation\r\ta\t=1694.6 ± 56.8\r\tb\t=20.861 ± 0.278\r" X SetScale/P x 0,333.8353891,"", 'fit_limn 0_O2 mz 1368'; SetScale y 0,0,"", 'fit_limn 0_O2 mz 1368' X Note 'fit_limn 0_O2 mz 1368', "'fit_limn 0_O2 mz 1368'= W_coef[0]+W_coef[1]*x\rW_coef={1.6055,0.16249}\rV_chisq= 12.4114;V_npnts= 5;V_numNaNs= 0;V_numINFs= 0;\r\rV_startRow= 0;V_endRow= 4;V_q= 1;V_Rab= -0.816497;V_Pr= 0.996643;\rW_sigma={1.58,0.00771}" X Note 'fit_limn 0_O2 mz 1368', "\rCoefficient values ± one standard deviation\r\ta\t=1.6055 ± 1.58\r\tb\t=0.16249 ± 0.00771\r" X SetScale/P x 0,333.8353891,"", 'fit_limn 0_O2 mz 135'; SetScale y 0,0,"", 'fit_limn 0_O2 mz 135' X Note 'fit_limn 0_O2 mz 135', "'fit_limn 0_O2 mz 135'= W_coef[0]+W_coef[1]*x\rW_coef={-13.524,0.25267}\rV_chisq= 146.535;V_npnts= 5;V_numNaNs= 0;V_numINFs= 0;\r\rV_startRow= 0;V_endRow= 4;V_q= 1;V_Rab= -0.816497;V_Pr= 0.98392;\rW_sigma={5.41,0.0265}" X Note 'fit_limn 0_O2 mz 135', "\rCoefficient values ± one standard deviation\r\ta\t=-13.524 ± 5.41\r\tb\t=0.25267 ± 0.0265\r" WAVES/D apineneSH apineneSHdev bpineneSH bpineneSHdev LimoneneSH limoneneSHdev myrceneSH myrceneSHdev ocimeneSH ocimeneSHdev BEGIN 0 0.017327 0 0.017327 0 0.017327 0 0.017327 0 0.017327 2.021483333 0.264674297 1.761578333 0.132337148 1.7327 0.17327 1.790456667 0.100037481 1.842437667 0.16099509 3.580913333 0.100037481 3.546259333 0.087210654 3.523156667 0.264674297 3.598240333 0.16099509 3.505829667 0.13897651 6.873043333 0.100037481 6.959678333 0.09852549300000001 7.005883667 0.088915258 6.959678333 0.132337148 7.017435 0.086635 10.41930267 0.040014992 10.45395667 0.131197927 10.482835 0.086635 10.482835 0.229214665 10.448181 0.105396026 13.8616 0.17327 14.000216 0.124946774 13.80384333 0.100037481 13.90780533 0.111397024 13.89047833 0.180345134 END X SetScale/P x 0,1,"", apineneSH; SetScale y 0,0,"", apineneSH X SetScale/P x 0,1,"", apineneSHdev; SetScale y 0,0,"", apineneSHdev X SetScale/P x 0,1,"", bpineneSH; SetScale y 0,0,"", bpineneSH X SetScale/P x 0,1,"", bpineneSHdev; SetScale y 0,0,"", bpineneSHdev X SetScale/P x 0,1,"", LimoneneSH; SetScale y 0,0,"", LimoneneSH X SetScale/P x 0,1,"", limoneneSHdev; SetScale y 0,0,"", limoneneSHdev X SetScale/P x 0,1,"", myrceneSH; SetScale y 0,0,"", myrceneSH X SetScale/P x 0,1,"", myrceneSHdev; SetScale y 0,0,"", myrceneSHdev X SetScale/P x 0,1,"", ocimeneSH; SetScale y 0,0,"", ocimeneSH X SetScale/P x 0,1,"", ocimeneSHdev; SetScale y 0,0,"", ocimeneSHdev