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2-Butanone, 1-(1H-benzimidazol-2-ylthio)-1-phenyl-
SpectraBase Compound ID 6gSVkt6xvHy
InChI InChI=1S/C17H16N2OS/c1-2-15(20)16(12-8-4-3-5-9-12)21-17-18-13-10-6-7-11-14(13)19-17/h3-11,16H,2H2,1H3,(H,18,19)
InChIKey PFJDMZLTGHFZGS-UHFFFAOYSA-N
Mol Weight 296.39 g/mol
Molecular Formula C17H16N2OS
Exact Mass 296.098334 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K1ZoRl5NqEp
Name 2-Butanone, 1-(1H-benzimidazol-2-ylthio)-1-phenyl-
Alternate Name(s) 1-(1H-benzimidazol-2-ylsulfanyl)-1-phenyl-2-butanone 1-(benzimidazol-2-ylthio)-1-phenyl-2-butanone
CAS Registry Number 95110-63-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16N2OS
InChI InChI=1S/C17H16N2OS/c1-2-15(20)16(12-8-4-3-5-9-12)21-17-18-13-10-6-7-11-14(13)19-17/h3-11,16H,2H2,1H3,(H,18,19)
InChIKey PFJDMZLTGHFZGS-UHFFFAOYSA-N
Molecular Weight 296.388 g/mol
SMILES [nH]1c2ccccc2nc1SC(C(=O)CC)c1ccccc1
SPLASH splash10-000f-0090000000-c169598077b15a1f3d9f
Source of Spectrum AJ-58-2853-5
Wiley ID 1299124