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Cyclohexanone, 2-[3-(phenylthio)-2-propenyl]-, (Z)-
SpectraBase Compound ID 9iPLJ2wsH2C
InChI InChI=1S/C15H18OS/c16-15-11-5-4-7-13(15)8-6-12-17-14-9-2-1-3-10-14/h1-3,6,9-10,12-13H,4-5,7-8,11H2/b12-6-
InChIKey HDLWQGBVLFLOGY-SDQBBNPISA-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 6LLvXI8yuky
Name Cyclohexanone, 2-[3-(phenylthio)-2-propenyl]-, (Z)-
Alternate Name(s) (Z)-2-(3-phenylthio-2-propenyl)cyclohexanone 2-[(2Z)-3-(phenylsulfanyl)-2-propenyl]cyclohexanone
CAS Registry Number 102438-34-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18OS
InChI InChI=1S/C15H18OS/c16-15-11-5-4-7-13(15)8-6-12-17-14-9-2-1-3-10-14/h1-3,6,9-10,12-13H,4-5,7-8,11H2/b12-6-
InChIKey HDLWQGBVLFLOGY-SDQBBNPISA-N
Molecular Weight 246.368 g/mol
SMILES C1(=O)C(C\C=C/Sc2ccccc2)CCCC1
SPLASH splash10-00kk-1920000000-b4122a9a6be8907a1f0b
Source of Spectrum KC-1989-1636-5
Wiley ID 1249134