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Benzenemethanol, .alpha.-[2-methyl-1-(phenylthio)-2-propenyl]-
SpectraBase Compound ID IRqeGmmoG0j
InChI InChI=1S/C17H18OS/c1-13(2)17(19-15-11-7-4-8-12-15)16(18)14-9-5-3-6-10-14/h3-12,16-18H,1H2,2H3
InChIKey ORLVFSLMTJRWHP-UHFFFAOYSA-N
Mol Weight 270.39 g/mol
Molecular Formula C17H18OS
Exact Mass 270.107836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E6OD8orCVwL
Name Benzenemethanol, .alpha.-[2-methyl-1-(phenylthio)-2-propenyl]-
Alternate Name(s) 3-Methyl-1-phenyl-2-(phenylsulfanyl)-3-buten-1-ol 3-Methyl-1-phenyl-2-(phenylthio)but-3-en-1-ol
CAS Registry Number 76126-89-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18OS
InChI InChI=1S/C17H18OS/c1-13(2)17(19-15-11-7-4-8-12-15)16(18)14-9-5-3-6-10-14/h3-12,16-18H,1H2,2H3
InChIKey ORLVFSLMTJRWHP-UHFFFAOYSA-N
Molecular Weight 270.390 g/mol
SMILES OC(C(Sc1ccccc1)C(=C)C)c1ccccc1
SPLASH splash10-03di-3900000000-71bacf9d88db428a3da3
Source of Spectrum B-33-1354-0
Wiley ID 1274532