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2-Methyl-4-phenyl-tetrahydrothiopyran

View entire compound with spectra: 1 MS (GC)

2-Methyl-4-phenyl-tetrahydrothiopyran
SpectraBase Compound ID CXx4Sk7khE9
InChI InChI=1S/C12H16S/c1-10-9-12(7-8-13-10)11-5-3-2-4-6-11/h2-6,10,12H,7-9H2,1H3
InChIKey BTNDCHWOHKVDLC-UHFFFAOYSA-N
Mol Weight 192.32 g/mol
Molecular Formula C12H16S
Exact Mass 192.097272 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F3WdHHeTHAF
Name 2-Methyl-4-phenyl-tetrahydrothiopyran
Alternate Name(s) 2-Methyl-4-phenyl-thiane cis-2-Methyl-4-phenylthiane trans-2-Methyl-4-phenylthiane
CAS Registry Number 76097-69-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16S
InChI InChI=1S/C12H16S/c1-10-9-12(7-8-13-10)11-5-3-2-4-6-11/h2-6,10,12H,7-9H2,1H3
InChIKey BTNDCHWOHKVDLC-UHFFFAOYSA-N
Molecular Weight 192.320 g/mol
SMILES c1ccc(cc1)C1CCSC(C1)C
SPLASH splash10-0006-2900000000-55c28b905d5dcd78d23f
Source of Spectrum HC-17-240-0
Wiley ID 1188867