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7-(Phenylthio)-7-octen-2-one

View entire compound with spectra: 1 MS (GC)

7-(Phenylthio)-7-octen-2-one
SpectraBase Compound ID 1UHv02y4mnk
InChI InChI=1S/C14H18OS/c1-12(15)8-6-7-9-13(2)16-14-10-4-3-5-11-14/h3-5,10-11H,2,6-9H2,1H3
InChIKey USIYEFZRUDRQGB-UHFFFAOYSA-N
Mol Weight 234.36 g/mol
Molecular Formula C14H18OS
Exact Mass 234.107836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LbPVMfMxyAi
Name 7-(Phenylthio)-7-octen-2-one
Alternate Name(s) 7-(Phenylsulfanyl)-7-octen-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18OS
InChI InChI=1S/C14H18OS/c1-12(15)8-6-7-9-13(2)16-14-10-4-3-5-11-14/h3-5,10-11H,2,6-9H2,1H3
InChIKey USIYEFZRUDRQGB-UHFFFAOYSA-N
Molecular Weight 234.357 g/mol
SMILES C(Sc1ccccc1)(=C)CCCCC(=O)C
SPLASH splash10-004j-7920000000-29693748ad68173a714a
Source of Spectrum C-115-7224-0
Wiley ID 1236062