https://github.com/loftytopping/STRAPS
Tip revision: 5e139970b7facf519be2ed3e999e3dca2a1cd34d authored by David Topping on 27 June 2017, 13:58:36 UTC
Update README.md
Update README.md
Tip revision: 5e13997
L_STD_W_052_NMethylisatoicAnhydride.itx
IGOR
WAVES/T DBInfoDesc_NMethylisa DBInfo_NMethylisa
BEGIN
"Source Signal Type" "laboratory standards (L_STD_*_xxx_yyyy)"
"Experimentor Name" "Allison C. Aiken"
"Research Group" "Jimenez Group, Colorado-Boulder"
"ToF Type (C,V,W)" "W"
"Citation URL" "http://pubs.acs.org/doi/pdf/10.1021/ac071150w"
"Citation" "Aiken et al., Anal Chem, 2007, Vol.79 pp. 8350-8358, SRef-ID: doi:10.1021/ac071150w"
"Citation Fig#" "NA"
"Comments" ""
"EI volts" "70.0"
"Vaporizer Temp (Deg. C)" "600.0"
"local experiment todo wave name" "NMethylisatoic"
"" ""
"" ""
"" ""
"" ""
END
X SetScale/P x 0,1,"", DBInfoDesc_NMethylisa; SetScale y 0,0,"", DBInfoDesc_NMethylisa
X SetScale/P x 0,1,"", DBInfo_NMethylisa; SetScale y 0,0,"", DBInfo_NMethylisa
WAVES DiffStick_all_NMethylisa
BEGIN
0
0
0
0
0
0
0
0
0
0
0
1.065334
0.3353197
0.7274915
3.599297
1.416136
0.354826
1.281413
0.3044292
0
0.01458412
0.08059646
0.4803354
0.04324237
0.1704748
2.645873
5.254726
12.76516
2.564066
1.432531
1.576708
1.08843
-0.3947793
-0.006350453
-0.01289793
0.5475221
1.224136
2.695951
5.135754
0
0.7449932
0.6736567
0.5220142
14.13404
0.6757447
0.08752605
0.01411046
0.02764196
0.4028068
4.597005
5.461544
2.227127
0.843371
0.2401014
0.585622
0.2052713
0.2796323
0.04067373
0.07303659
0.06613807
0.6220968
1.557575
5.848351
5.427926
2.642185
1.029275
0.1578888
0.03945463
0.1852691
0.07120844
0.106201
0.03875892
0.3292125
1.597198
1.492774
2.497479
10.46787
10.10786
2.268435
0.2411125
0.0972698
0.0361682
0.06457025
0.03728318
0.06213679
0.0770482
0.1792574
0.3609763
0.5821241
3.00664
1.937921
5.88636
0.6553511
0.07601421
0.04651297
0.023128
0.05605102
0.02624656
0.1011495
0.05743117
0.09381033
0.4297115
0.9589951
17.61833
14.0591
2.203105
0.2333521
0.01198788
0.03153605
0.01077958
0.0324221
0.01656999
0.05179501
0.03685187
0.07085015
1.241303
0.7412714
0.3261485
2.301915
4.97644
0.4322895
0.0468816
0.01609343
0.0160383
0.039891
0.05824912
0.07992657
0.1161049
0.1156294
0.2356884
0.2900501
3.022081
5.337269
5.707974
0.5190943
0.07228591
0.03276658
0.02646141
0.09126081
0.09349872
0.02843116
0.02835657
0.01327748
0.0331793
0.03717878
1.029856
0.2152078
0.1722409
0.09283691
0.05683392
1.722459
0.2752504
0.08214618
0.1076321
0.04158122
0.01434472
0.00916018
0.001695635
0.006217138
0.03649071
0.02117974
0.02244822
0.05260449
0.07205781
0.1290065
0.1388116
0.1807844
0.08785404
0.08967765
0.006908194
0.004876331
0.001976175
0.002511502
0.005666392
0.01082127
0.009903925
1.316077
0.281371
0.199577
0.2151428
0.2667106
0.10415
0.01901281
0.02074149
0.000502063
0.00477393
0.002928648
0.008752712
0.008220466
0.03834831
0.04197358
0.07864052
0.08046369
0.1062667
0.1723037
0.08696843
0.01430358
0.008659191
-0.0008656526
0.002616805
0.007685889
0.01885116
0.03552486
0.04928458
0.1612215
0.1200419
0.3337971
0.2331327
0.1029835
0.08008436
0.03166947
0.003758935
0.005101228
0.006813564
0.02277556
0.01077039
0.03231803
0.07209592
0.07177607
0.08386381
0.1811149
0.08285353
0.3675178
0.1053065
0.02876302
0.01159972
0.005691255
0.01135495
0.01366948
0.01107386
0.01237609
0.02071261
0.1030816
0.3372785
0.2240998
0.04990683
0.1770825
0.2949691
0.08139258
0.02240377
0.005962843
0.007866887
0.005898203
0.006491487
0.001741777
0.007202281
0.01746611
0.04113805
0.07017919
0.04551807
0.07941949
0.3362633
0.335495
0.06072466
0.01551508
0.007112205
0.001177247
0.006383501
0.004119651
0.002349804
0.005905183
0.001039619
0.01447648
0.01469959
0.0613273
0.0396215
0.03765151
0.04475752
0.0247062
0.2302745
0.06831801
0.01358012
0.002932078
0.003157406
0.002391131
0.005895147
0.004439319
0.003930048
0.02051201
0.01658491
0.01999465
0.01706573
0.01460388
0.08198795
0.01514687
0.005689461
0.00232216
-0.0003535293
0.002442608
0.003298089
0.002946533
0.01204104
0.01857668
0.01599723
0.02332845
0.03299204
0.05918935
0.01916498
0.003859934
END
SMILES CN1C2=CC=CC=C2C(=O)OC1=O
X SetScale/P x 0,1,"", DiffStick_all_NMethylisa; SetScale y 0,0,"", DiffStick_all_NMethylisa
X Display /W=(260,130,660,330)
X AppendtoGraph DiffStick_all_NMethylisa vs amu_wave_NMethylisa
X ModifyGraph rgb(DiffStick_all_NMethylisa)=(1,1,1)
X ModifyGraph mode=1
X ModifyGraph toMode=3
X Label bottom "m/z"
X ModifyGraph lsize=2
X legend
X Edit/W=(5.25,42.5,450.75,370.25) DBInfoDesc_NMethylisa,DBInfo_NMethylisa
X ModifyTable format(Point)=1,width(DBInfoDesc_NMethylisa)=134,width(DBInfo_NMethylisa)=144