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Name
Formula / Structure
ExactMass
ID
6-Methylthioguanine
31 spectra
C6H7N5S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
181.04221
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL2311093121
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL231109947
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL2311093113
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL231109945
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL2311093116
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL231109950
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL2311093118
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL231109948
LC-ESI-QTOF; MS2; 130 V
MSBNK-BAFG-CSL2311093110
LC-ESI-QTOF; MS2; 130 V
MSBNK-BAFG-CSL231109956
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL2311093109
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL231109953
LC-ESI-QTOF; MS2; 150 V
MSBNK-BAFG-CSL2311093120
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL2311093108
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL231109946
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL2311093123
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL231109957
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311093112
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311093114
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL231109952
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL231109958
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL2311093119
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL231109949
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL2311093117
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL231109954
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL2311093115
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL231109944
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL2311093122
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL231109951
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL2311093111
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL231109955
6-METHYLTHIOHEXANENITRILE
1 spectrum
C7H13NS
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
143.07687
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP000923
6-Methylthioinosin
29 spectra
C11H14N4O4S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
298.07361
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL2311092215
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL2311096233
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL2311092225
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL2311096236
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL2311092214
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL2311096239
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL2311092223
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL2311096231
LC-ESI-QTOF; MS2; 130 V
MSBNK-BAFG-CSL2311096246
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL2311096243
LC-ESI-QTOF; MS2; 150 V
MSBNK-BAFG-CSL2311096245
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL2311092220
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL2311096232
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL2311092226
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL2311096240
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311092216
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311092221
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311096238
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311096242
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL2311092224
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL2311096237
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL2311092222
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL2311096241
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL2311092218
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL2311096234
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL2311092219
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL2311096244
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL2311092217
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL2311096235
6-Monoacetylmorphine
1 spectrum
C19H21NO4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
327.14706
LC-ESI-QTOF; MS2; CE: RAMP 22.2-33.2 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU157406
6-NITRO-2-PHENYLINDOLIZINE
1 spectrum
C14H10N2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
238.07423
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP004412
6-Nitrobenzimidazole
18 spectra
C7H5N3O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
163.03818
ESI-QTOF; MS2; CE: 10; [M+H]+
MSBNK-EPA-ENTACT_AGILENT002229
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002232
ESI-QTOF; MS2; CE: 20; [M+H]+
MSBNK-EPA-ENTACT_AGILENT002230
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002233
ESI-QTOF; MS2; CE: 40; [M+H]+
MSBNK-EPA-ENTACT_AGILENT002234
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002231
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
MSBNK-LCSB-LU092201
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
MSBNK-LCSB-LU092251
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
MSBNK-LCSB-LU092202
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
MSBNK-LCSB-LU092252
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
MSBNK-LCSB-LU092203
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
MSBNK-LCSB-LU092253
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
MSBNK-LCSB-LU092204
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
MSBNK-LCSB-LU092254
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
MSBNK-LCSB-LU092205
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
MSBNK-LCSB-LU092255
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
MSBNK-LCSB-LU092206
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
MSBNK-LCSB-LU092256
6-NITROQUINOLINE
1 spectrum
C9H6N2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
174.04292
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP010536
6-O-beta-D-Glucopyranosyl-D-glucose, beta-D-glucop...
1 spectrum
C12H22O11
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
342.29700
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS119207
6-O-METHYL-1,2,3,4,5-PENTA-O-ACETYL GLUCITOL
1 spectrum
C17H26O11
406.14752
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP000812
6-O-METHYL-1,2,3,4,5-PENTA-O-ACETYL-GLUCITOL
2 spectra
C17H26O11
406.14752
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP000815
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP000816
6-Oxo-5a-cholan-24-oic acid
4 spectra
C24H38O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
374.28210
LC-ESI-TOF; MS; NEGATIVE; in source decay -150 V
MSBNK-Nihon_Univ-NU000705
LC-ESI-TOF; MS; NEGATIVE; in source decay -30 V
MSBNK-Nihon_Univ-NU000701
LC-ESI-TOF; MS; NEGATIVE; in source decay -60 V
MSBNK-Nihon_Univ-NU000702
LC-ESI-TOF; MS; NEGATIVE; in source decay -90 V
MSBNK-Nihon_Univ-NU000703
6-Oxo-5b-cholan-24-oic Acid
5 spectra
C24H38O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
374.28210
LC-ESI-TOF; MS; NAGATIVE; in source decay -120 V
MSBNK-Nihon_Univ-NU000659
LC-ESI-TOF; MS; NAGATIVE; in source decay -150 V
MSBNK-Nihon_Univ-NU000660
LC-ESI-TOF; MS; NEGATIVE; in source decay -30 V
MSBNK-Nihon_Univ-NU000656
LC-ESI-TOF; MS; NEGATIVE; in source decay -60 V
MSBNK-Nihon_Univ-NU000657
LC-ESI-TOF; MS; NEGATIVE; in source decay -90 V
MSBNK-Nihon_Univ-NU000658
6-Oxopurine, Sarcine, HX, Sarkine, Hypoxanthine en...
3 spectra
C5H4N4O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
136.11400
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS025201
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS025202
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS025203
6-PENTYL-2-PYRONE
1 spectrum
C10H14O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
166.09938
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP005663
6-Pentyl-2H-pyran-2-one
6 spectra
C10H14O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
166.09940
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
MSBNK-LCSB-LU079501
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
MSBNK-LCSB-LU079502
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
MSBNK-LCSB-LU079503
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
MSBNK-LCSB-LU079504
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
MSBNK-LCSB-LU079505
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
MSBNK-LCSB-LU079506
6-PENTYL-ALPHA-PYRONE
1 spectrum
C10H14O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
166.09938
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP007766
6-PG-Ba, 1pgp, 6-Phosphogluconic acid Barium salt ...
1 spectrum
C6H13O10P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
276.13599
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS003807
6-Phenyl-1,3,5-triazine-2,4-diamine
9 spectra
C9H9N5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
187.08580
ESI-QTOF; MS2; CE: 10; [M+H]+
MSBNK-EPA-ENTACT_AGILENT002095
ESI-QTOF; MS2; CE: 20; [M+H]+
MSBNK-EPA-ENTACT_AGILENT002094
ESI-QTOF; MS2; CE: 40; [M+H]+
MSBNK-EPA-ENTACT_AGILENT002096
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
MSBNK-LCSB-LU106301
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
MSBNK-LCSB-LU106302
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
MSBNK-LCSB-LU106303
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
MSBNK-LCSB-LU106304
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
MSBNK-LCSB-LU106305
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
MSBNK-LCSB-LU106306
6-PHENYL-2-HEXENYL VINYL ETHER
1 spectrum
C14H18O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
202.13577
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP009854
6-PHENYL-4-METHYLTHIO-1-HEXENE
1 spectrum
C13H18S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
206.11292
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP002511
6-PHENYLDODECANE
1 spectrum
C18H30
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
246.23476
CI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP012317
6-PHENYLTRIDECANE
1 spectrum
C19H32
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
260.25040
CI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP012323
6-PHENYLUNDECANE
1 spectrum
C17H28
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
232.21910
CI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP012311
6-Phospho-D-gluconic acid
9 spectra
C6H13O10P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
276.02463
LC-ESI-ITFT; MS2; m/z:194.93; NEG
MSBNK-NAIST-KNA00749
LC-ESI-ITFT; MS2; m/z:275.02; NEG
MSBNK-NAIST-KNA00750
LC-ESI-ITFT; MS2; m/z:372.98; NEG
MSBNK-NAIST-KNA00751
LC-ESI-ITFT; MS; NEG
MSBNK-NAIST-KNA00748
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO001600
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO001601
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO001602
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO001603
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO001604
6-Prenylnaringenin
5 spectra
C20H20O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
340.13110
LC-ESI-QTOF; MS
MSBNK-BS-BS003084
LC-ESI-QTOF; MS2; CE:10 eV; [M-H]-
MSBNK-BS-BS003086
LC-ESI-QTOF; MS2; CE:20 eV; [M-H]-
MSBNK-BS-BS003087
LC-ESI-QTOF; MS2; CE:30 eV; [M-H]-
MSBNK-BS-BS003083
LC-ESI-QTOF; MS2; CE:40 eV; [M-H]-
MSBNK-BS-BS003085
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