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2-(Phenylthio)-1-cyclodecanone
SpectraBase Compound ID HPR58jGm2if
InChI InChI=1S/C16H22OS/c17-15-12-8-3-1-2-4-9-13-16(15)18-14-10-6-5-7-11-14/h5-7,10-11,16H,1-4,8-9,12-13H2
InChIKey OMGZLOLZCLVIHI-UHFFFAOYSA-N
Mol Weight 262.41 g/mol
Molecular Formula C16H22OS
Exact Mass 262.139137 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BYrydkPGJFW
Name 2-(Phenylthio)-1-cyclodecanone
Alternate Name(s) 2-(Phenylthio)cyclodecanone 2-Phenylsulfanylcyclodecan-1-one
CAS Registry Number 125334-78-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22OS
InChI InChI=1S/C16H22OS/c17-15-12-8-3-1-2-4-9-13-16(15)18-14-10-6-5-7-11-14/h5-7,10-11,16H,1-4,8-9,12-13H2
InChIKey OMGZLOLZCLVIHI-UHFFFAOYSA-N
Molecular Weight 262.411 g/mol
SMILES C1(Sc2ccccc2)C(=O)CCCCCCCC1
SPLASH splash10-08fr-3930000000-7409b6a93d357a1edb9d
Source of Spectrum KC-1989-306-11
Wiley ID 1266085