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(3E)-1-[1-(Phenylsulfanyl)cyclohexyl]-4-phenylbut-3-en-1-one
SpectraBase Compound ID KBRk3Asx3zB
InChI InChI=1S/C22H24OS/c23-21(16-10-13-19-11-4-1-5-12-19)22(17-8-3-9-18-22)24-20-14-6-2-7-15-20/h1-2,4-7,10-15H,3,8-9,16-18H2/b13-10+
InChIKey RORMDQLXRGHNBN-JLHYYAGUSA-N
Mol Weight 336.49 g/mol
Molecular Formula C22H24OS
Exact Mass 336.154787 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HIKJb5d9cr2
Name (3E)-1-[1-(Phenylsulfanyl)cyclohexyl]-4-phenylbut-3-en-1-one
Alternate Name(s) (3E)-4-phenyl-1-[1-(phenylsulfanyl)cyclohexyl]-3-buten-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24OS
InChI InChI=1S/C22H24OS/c23-21(16-10-13-19-11-4-1-5-12-19)22(17-8-3-9-18-22)24-20-14-6-2-7-15-20/h1-2,4-7,10-15H,3,8-9,16-18H2/b13-10+
InChIKey RORMDQLXRGHNBN-JLHYYAGUSA-N
Molecular Weight 336.493 g/mol
SMILES C1(Sc2ccccc2)(C(=O)C\C=C\c2ccccc2)CCCCC1
SPLASH splash10-0006-0911000000-720176397296e46141eb
Source of Spectrum K-2002-2655-8
Wiley ID 1613342