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2-(3-(Phenylthio)propyl)cyclohexanone
SpectraBase Compound ID 7MaP2RIE9hR
InChI InChI=1S/C15H20OS/c16-15-11-5-4-7-13(15)8-6-12-17-14-9-2-1-3-10-14/h1-3,9-10,13H,4-8,11-12H2
InChIKey CGJQSKUULUXOGJ-UHFFFAOYSA-N
Mol Weight 248.38 g/mol
Molecular Formula C15H20OS
Exact Mass 248.123486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 12p80CKViqG
Name 2-(3-(Phenylthio)propyl)cyclohexanone
Alternate Name(s) 2-[3-(Phenylsulfanyl)propyl]cyclohexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20OS
InChI InChI=1S/C15H20OS/c16-15-11-5-4-7-13(15)8-6-12-17-14-9-2-1-3-10-14/h1-3,9-10,13H,4-8,11-12H2
InChIKey CGJQSKUULUXOGJ-UHFFFAOYSA-N
Molecular Weight 248.384 g/mol
SMILES C1(=O)C(CCCSc2ccccc2)CCCC1
SPLASH splash10-000i-0930000000-7061c9e6de84821083c2
Source of Spectrum F-53-17615-10
Wiley ID 805069