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Name
Formula / Structure
ExactMass
ID
(3S,4S)-5-BENZYLOXY-3-METHOXYETHOXYMETHOXY-4-METHY...
1 spectrum
C17H28O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
312.19366
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP007263
(3S,4S)-5-BENZYLOXY-3-METHOXYETHOXYMETHOXY-4-METHY...
1 spectrum
C17H26O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
310.17801
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP007283
(3S,5R)-Nona-1,8-diene-3,5-diol
2 spectra
C9H16O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
156.11504
GC-EI-TOF; MS; positive; EI; 70 V
MSBNK-MSSJ-MSJ02064
GC-FI-TOF; MS; positive; FI; 10 kV
MSBNK-MSSJ-MSJ02065
(3S,5S)-3-HYDROXY-1-METHYL-5-(3-PYRIDINYL)-2-PYRRO...
1 spectrum
C10H12N2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
192.08987
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP012072
(3S,5S)-Nona-1,8-diene-3,5-diol
2 spectra
C9H16O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
156.11504
GC-EI-TOF; MS; POSITIVE; EI; 70 V
MSBNK-MSSJ-MSJ02062
GC-FI-TOF; MS; positive; FI; 10 kV
MSBNK-MSSJ-MSJ02063
(3S,6R)-6-(TERT-BUTYLDIMETHYLSILOXY)-3-METHYLNONEN...
1 spectrum
C16H30OSi
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
266.20660
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP002465
(4'AS,5'S,8'AS)-E-(+)-3-METHYL-5-((5'ALPHA-(4'-MET...
1 spectrum
C25H40O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
372.30283
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP007993
(4-(2,6-dichlorophenyl)-2-methylbutyl)(pentyl)sulf...
2 spectra
C16H24Cl2S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
318.09760
GC-EI-TOF; MS; POSITIVE; EI; 70 V
MSBNK-MSSJ-MSJ02108
GC-FI-TOF; MS; POSITIVE; FI; 10 kV
MSBNK-MSSJ-MSJ02109
(4-(4-bromophenyl)-2-methylbutyl)(pentyl)sulfane
2 spectra
C16H25BrS
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
328.08603
GC-EI-TOF; MS; POSITIVE; EI; 70 V
MSBNK-MSSJ-MSJ02106
GC-FI-TOF; MS; POSITIVE; FI; 10 kV
MSBNK-MSSJ-MSJ02107
(4-Aminophenyl)arsonic acid
12 spectra
C6H8AsNO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
216.97200
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
MSBNK-LCSB-LU040601
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
MSBNK-LCSB-LU040651
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
MSBNK-LCSB-LU040602
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
MSBNK-LCSB-LU040652
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
MSBNK-LCSB-LU040603
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
MSBNK-LCSB-LU040653
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
MSBNK-LCSB-LU040604
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
MSBNK-LCSB-LU040654
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
MSBNK-LCSB-LU040605
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
MSBNK-LCSB-LU040655
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
MSBNK-LCSB-LU040606
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
MSBNK-LCSB-LU040656
(4-BROMO-(E)-1-BUTENYL)BENZENE
1 spectrum
C10H11Br
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
210.00441
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP004638
(4-Carboxybutyl)triphenylphosphonium
16 spectra
[C23H24O2P]+
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
363.15079
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL23111011905
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL23111011892
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL23111011900
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL23111011897
LC-ESI-QTOF; MS2; 130 V
MSBNK-BAFG-CSL23111011904
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL23111011903
LC-ESI-QTOF; MS2; 150 V
MSBNK-BAFG-CSL23111011899
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL23111011894
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL23111011893
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111011895
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111011898
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL23111011901
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL23111011896
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL23111011891
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL23111011890
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL23111011902
(4-Chloro-2-methylphenoxy)acetic acid
16 spectra
C9H9ClO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
200.02400
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL23111014254
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL23111014251
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL23111014240
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL23111014255
LC-ESI-QTOF; MS2; 130 V
MSBNK-BAFG-CSL23111014250
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL23111014242
LC-ESI-QTOF; MS2; 150 V
MSBNK-BAFG-CSL23111014247
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL23111014246
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL23111014253
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111014241
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111014243
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL23111014249
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL23111014244
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL23111014252
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL23111014248
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL23111014245
(4-chloro-2-methylphenoxy)acetic acid
1 spectrum
C9H9ClO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
200.02400
LC-ESI-ITFT; MS2; CE: 50%; R=7500; [M-H]-
MSBNK-MetaboLights-ML000251
(4-Chlorobenzyl)-triphenylphosphonium
16 spectra
[C25H21ClP]+
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
387.10641
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL231109356
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL231109354
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL231109344
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL231109345
LC-ESI-QTOF; MS2; 130 V
MSBNK-BAFG-CSL231109346
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL231109352
LC-ESI-QTOF; MS2; 150 V
MSBNK-BAFG-CSL231109357
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL231109350
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL231109347
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL231109349
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL231109353
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL231109343
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL231109351
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL231109348
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL231109358
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL231109355
(4-METHOXYPHENYL)ACETIC ACID
1 spectrum
C9H10O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
166.06299
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP010380
(4-METHOXYPHENYL)PROPIONIC ACID
1 spectrum
C10H12O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
180.07864
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP010384
(4-METHYLTHIO)BENZYL BENZOATE
1 spectrum
C15H14O2S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
258.07144
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP009675
(4-nitrophenyl) dihydrogen phosphate, p-Nitropheny...
3 spectra
C6H6NO6P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
219.09100
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT103260
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT203260
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT203263
(4-PHENYL-2-BUTENYL)TRIMETHYLSILANE
1 spectrum
C13H20Si
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
204.13342
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP004983
(4-PHENYL-3-BUTENYL)TRIMETHYLSILANE
1 spectrum
C13H20Si
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
204.13342
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP004984
(4ALPHA)-ACETYL-1(2H)-METHYLENE-3,4,4A,5,6,7,8,(8A...
1 spectrum
C13H20O
192.15141
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP005229
(4AS,5S)-(+)-1,4ABETA-DIMETHYL-5BETA((P-BROMOBENZO...
1 spectrum
C19H21BrO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
376.06741
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP006368
(4AS,5S,8AS)-(+)-5BETA,8ABETA-DIMETHYL-2-FORMYL-5A...
1 spectrum
C19H28O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
288.20892
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP007999
(4AS,5S,8AS)-(-)-5ALPHA-(3-HYDROXYPROPYL)-8A-METHO...
1 spectrum
C19H34O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
342.24063
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP008012
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