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(1SR,2RS)-syn and (1SR,2SR)-anti-2-Methyl-2-phenylthiocyclohexanol
SpectraBase Compound ID 3LkPtJb2Z0H
InChI InChI=1S/C13H18OS/c1-13(10-6-5-9-12(13)14)15-11-7-3-2-4-8-11/h2-4,7-8,12,14H,5-6,9-10H2,1H3
InChIKey UJJHXTQOQRNUBO-UHFFFAOYSA-N
Mol Weight 222.35 g/mol
Molecular Formula C13H18OS
Exact Mass 222.107836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7XkN1WtPOOy
Name (1SR,2RS)-syn and (1SR,2SR)-anti-2-Methyl-2-phenylthiocyclohexanol
Alternate Name(s) 2-Methyl-2-(phenylsulfanyl)cyclohexanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18OS
InChI InChI=1S/C13H18OS/c1-13(10-6-5-9-12(13)14)15-11-7-3-2-4-8-11/h2-4,7-8,12,14H,5-6,9-10H2,1H3
InChIKey UJJHXTQOQRNUBO-UHFFFAOYSA-N
Molecular Weight 222.346 g/mol
SMILES OC1C(Sc2ccccc2)(C)CCCC1
SPLASH splash10-03di-2910000000-6240ad1d5c84e00d3e3e
Source of Spectrum KC-1992-2612-5
Wiley ID 776996