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1,2-Dimethyl-4-hydroxymethylcyclohexen-5-yl Benzyl Sulfide
SpectraBase Compound ID 9BFAMJzMigI
InChI InChI=1S/C16H22OS/c1-12-8-15(10-17)16(9-13(12)2)18-11-14-6-4-3-5-7-14/h3-7,15-17H,8-11H2,1-2H3
InChIKey GUVLYVSZJBKVRL-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 6n3Rwo2WqXc
Name 1,2-Dimethyl-4-hydroxymethylcyclohexen-5-yl Benzyl Sulfide
Alternate Name(s) [6-(benzylsulfanyl)-3,4-dimethyl-3-cyclohexen-1-yl]methanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22OS
InChI InChI=1S/C16H22OS/c1-12-8-15(10-17)16(9-13(12)2)18-11-14-6-4-3-5-7-14/h3-7,15-17H,8-11H2,1-2H3
InChIKey GUVLYVSZJBKVRL-UHFFFAOYSA-N
Molecular Weight 262.411 g/mol
SMILES OCC1CC(=C(CC1SCc1ccccc1)C)C
SPLASH splash10-0a4l-3900000000-ebefef931bdf0d96c6ef
Source of Spectrum KC-61-1123-18
Wiley ID 1627376