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2-Propanone, 1-(1-cyclohexen-1-yl)-3-(phenylthio)-
SpectraBase Compound ID Fa3gPnjYb73
InChI InChI=1S/C15H18OS/c16-14(11-13-7-3-1-4-8-13)12-17-15-9-5-2-6-10-15/h2,5-7,9-10H,1,3-4,8,11-12H2
InChIKey DWOZONRXFSSOEO-UHFFFAOYSA-N
Mol Weight 246.37 g/mol
Molecular Formula C15H18OS
Exact Mass 246.107836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1czGVV0wr7K
Name 2-Propanone, 1-(1-cyclohexen-1-yl)-3-(phenylthio)-
Alternate Name(s) 1-(1-cyclohexen-1-yl)-3-(phenylsulfanyl)acetone 3-(cyclohexene-1-yl)-1-phenylthio-2-propanone
CAS Registry Number 111731-06-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18OS
InChI InChI=1S/C15H18OS/c16-14(11-13-7-3-1-4-8-13)12-17-15-9-5-2-6-10-15/h2,5-7,9-10H,1,3-4,8,11-12H2
InChIKey DWOZONRXFSSOEO-UHFFFAOYSA-N
Molecular Weight 246.368 g/mol
SMILES C1(=CCCCC1)CC(=O)CSc1ccccc1
SPLASH splash10-05fs-9810000000-72956b51ef397e3528cb
Source of Spectrum F-43-2482-4
Wiley ID 1249129