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2-(2,2,5,5-Tetramethyl-2,5-dihydro-1H-pyrrol-3-ylmethylsulfanyl)-1H-benzimidazole-4-carboxylic Acid Amide
SpectraBase Compound ID DTMREN8vvDZ
InChI InChI=1S/C17H22N4OS/c1-16(2)8-10(17(3,4)21-16)9-23-15-19-12-7-5-6-11(14(18)22)13(12)20-15/h5-8,21H,9H2,1-4H3,(H2,18,22)(H,19,20)
InChIKey FJNUOZMJYDKTSX-UHFFFAOYSA-N
Mol Weight 330.45 g/mol
Molecular Formula C17H22N4OS
Exact Mass 330.151433 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7vyW4DkzTzi
Name 2-(2,2,5,5-Tetramethyl-2,5-dihydro-1H-pyrrol-3-ylmethylsulfanyl)-1H-benzimidazole-4-carboxylic Acid Amide
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22N4OS
InChI InChI=1S/C17H22N4OS/c1-16(2)8-10(17(3,4)21-16)9-23-15-19-12-7-5-6-11(14(18)22)13(12)20-15/h5-8,21H,9H2,1-4H3,(H2,18,22)(H,19,20)
InChIKey FJNUOZMJYDKTSX-UHFFFAOYSA-N
Instrument Name Automass Multi
Ionization Type EI
Literature Reference DOI 10.1021/jm801476y
Molecular Weight 330.450 g/mol
SMILES [nH]1c(nc2c(C(N)=O)cccc12)SCC=1C(C)(C)NC(C1)(C)C
SPLASH splash10-00di-0901000000-ad78b88a57cf7f480276
Source of Spectrum AF-52-SM14-13a
Wiley ID 1873739