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3-Benzylaminocarbonyl-2-(2-oxocyclohexylthio)pyridine
SpectraBase Compound ID ILD1lip4vtQ
InChI InChI=1S/C19H20N2O2S/c22-16-10-4-5-11-17(16)24-19-15(9-6-12-20-19)18(23)21-13-14-7-2-1-3-8-14/h1-3,6-9,12,17H,4-5,10-11,13H2,(H,21,23)
InChIKey MAUXOGMIMUNKJU-UHFFFAOYSA-N
Mol Weight 340.44 g/mol
Molecular Formula C19H20N2O2S
Exact Mass 340.124549 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FQbDLY27pKI
Name 3-Benzylaminocarbonyl-2-(2-oxocyclohexylthio)pyridine
Alternate Name(s) N-benzyl-2-((2-oxocyclohexyl)thio)nicotinamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20N2O2S
InChI InChI=1S/C19H20N2O2S/c22-16-10-4-5-11-17(16)24-19-15(9-6-12-20-19)18(23)21-13-14-7-2-1-3-8-14/h1-3,6-9,12,17H,4-5,10-11,13H2,(H,21,23)
InChIKey MAUXOGMIMUNKJU-UHFFFAOYSA-N
Literature Reference DOI 10.1002/prac.19973390129
Molecular Weight 340.441 g/mol
SMILES N(Cc1ccccc1)C(=O)c1c(nccc1)SC1C(CCCC1)=O
SPLASH splash10-00di-1109000000-a491ef78253a55bb8490
Source of Spectrum JF-399-157-18a
Wiley ID 1768330