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3-METHYLTHIAN

View entire compound with spectra: 10 NMR, and 3 MS (GC)

3-METHYLTHIAN
SpectraBase Compound ID CsKjy7Lg3oj
InChI InChI=1S/C6H12S/c1-6-3-2-4-7-5-6/h6H,2-5H2,1H3
InChIKey WTPRCAYZVQKROM-UHFFFAOYSA-N
Mol Weight 116.22 g/mol
Molecular Formula C6H12S
Exact Mass 116.065972 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ElvJ2XC7yEh
Name 2H-Thiopyran, tetrahydro-3-methyl-
Alternate Name(s) 3-Methyltetrahydro-2H-thiopyran 3-Methyltetrahydrothiopyran 3-Methylthiacyclohexane 3-Methylthiane Thiopyran, tetrahydro-3-methyl-
CAS Registry Number 5258-50-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H12S
InChI InChI=1S/C6H12S/c1-6-3-2-4-7-5-6/h6H,2-5H2,1H3
InChIKey WTPRCAYZVQKROM-UHFFFAOYSA-N
Molecular Weight 116.222 g/mol
SMILES CC1CCCSC1
SPLASH splash10-0gb9-9200000000-0371ca32f660e25fb17e
Source of Spectrum X-8-238-2
Wiley ID 1125818