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2-ACETAMIDO-4-ACETYL-1-PHENYLTHIOCYCLOHEXENE

View entire compound with spectra: 1 NMR, and 1 MS (GC)

2-ACETAMIDO-4-ACETYL-1-PHENYLTHIOCYCLOHEXENE
SpectraBase Compound ID J9Hlf8eXNmp
InChI InChI=1S/C16H19NO2S/c1-11(18)13-8-9-16(15(10-13)17-12(2)19)20-14-6-4-3-5-7-14/h3-7,13H,8-10H2,1-2H3,(H,17,19)
InChIKey SOKJJAQVZMKCBR-UHFFFAOYSA-N
Mol Weight 289.39 g/mol
Molecular Formula C16H19NO2S
Exact Mass 289.11365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4D7kmKPPPM
Name N-(5-acetyl-2-phenylsulfanyl-cyclohexen-1-yl)acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19NO2S
InChI InChI=1S/C16H19NO2S/c1-11(18)13-8-9-16(15(10-13)17-12(2)19)20-14-6-4-3-5-7-14/h3-7,13H,8-10H2,1-2H3,(H,17,19)
InChIKey SOKJJAQVZMKCBR-UHFFFAOYSA-N
Molecular Weight 289.393 g/mol
SMILES N(C1=C(Sc2ccccc2)CCC(C1)C(=O)C)C(=O)C
SPLASH splash10-053r-0900000000-54009c67881971eae0c1
Source of Spectrum KC-0-1696-11
Synonyms N-(5-ethanoyl-2-phenylsulfanyl-cyclohexen-1-yl)ethanamide N-[5-acetyl-2-(phenylthio)-1-cyclohexenyl]acetamide N-[5-acetyl-2-(phenylthio)cyclohexen-1-yl]acetamide
Wiley ID 822688