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2-Methyl-4-(4-methylsulfanylphenyl)but-3-yn-2-ol
SpectraBase Compound ID GYzhCI8rFOf
InChI InChI=1S/C12H14OS/c1-12(2,13)9-8-10-4-6-11(14-3)7-5-10/h4-7,13H,1-3H3
InChIKey IFKSCJVXNSJMER-UHFFFAOYSA-N
Mol Weight 206.3 g/mol
Molecular Formula C12H14OS
Exact Mass 206.076536 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Mee6hvSpsR
Name 2-Methyl-4-(4-methylsulfanylphenyl)but-3-yn-2-ol
Alternate Name(s) 2-Methyl-4-[4-(methylthio)phenyl]-3-butyn-2-ol 2-Methyl-4-[4-(methylthio)phenyl]but-3-yn-2-ol
CAS Registry Number 124153-81-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14OS
InChI InChI=1S/C12H14OS/c1-12(2,13)9-8-10-4-6-11(14-3)7-5-10/h4-7,13H,1-3H3
InChIKey IFKSCJVXNSJMER-UHFFFAOYSA-N
Molecular Weight 206.303 g/mol
SMILES OC(C#Cc1ccc(cc1)SC)(C)C
SPLASH splash10-000f-0900000000-bb4aae0430ad30eb2029
Source of Spectrum J-55-1316-17
Wiley ID 1204330