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2-Benzyl-6,6-bis(methylsulfanylmethyl)cyclohexa-2,4-dien-1-one
SpectraBase Compound ID EP4BSh61TJE
InChI InChI=1S/C17H20OS2/c1-19-12-17(13-20-2)10-6-9-15(16(17)18)11-14-7-4-3-5-8-14/h3-10H,11-13H2,1-2H3
InChIKey BGIQFFMLSNVGJY-UHFFFAOYSA-N
Mol Weight 304.47 g/mol
Molecular Formula C17H20OS2
Exact Mass 304.095558 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7y20oQ6mVWv
Name 2-Benzyl-6,6-bis(methylsulfanylmethyl)cyclohexa-2,4-dien-1-one
Alternate Name(s) 2-Benzyl-6,6-bis[(methylthio)methyl]cyclohexa-2,4-dien-1-one 6,6-bis(methylsulfanylmethyl)-2-(phenylmethyl)cyclohexa-2,4-dien-1-one 6,6-bis[(methylthio)methyl]-2-(phenylmethyl)-1-cyclohexa-2,4-dienone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20OS2
InChI InChI=1S/C17H20OS2/c1-19-12-17(13-20-2)10-6-9-15(16(17)18)11-14-7-4-3-5-8-14/h3-10H,11-13H2,1-2H3
InChIKey BGIQFFMLSNVGJY-UHFFFAOYSA-N
Molecular Weight 304.466 g/mol
SMILES C1(C(=CC=CC1(CSC)CSC)Cc1ccccc1)=O
SPLASH splash10-03dj-9400000000-95ef9e20c2e2ba31dce5
Source of Spectrum E1-41-442-4
Wiley ID 1551961