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S-Methyl 4-methylpentanethioate
SpectraBase Compound ID 9qUdWbsHnS1
InChI InChI=1S/C7H14OS/c1-6(2)4-5-7(8)9-3/h6H,4-5H2,1-3H3
InChIKey JOCKEOCKSBOIQA-UHFFFAOYSA-N
Mol Weight 146.25 g/mol
Molecular Formula C7H14OS
Exact Mass 146.076536 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9nfea2w5Dyz
Name S-Methyl 4-methylpentanethioate
CAS Registry Number 61122-71-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H14OS
InChI InChI=1S/C7H14OS/c1-6(2)4-5-7(8)9-3/h6H,4-5H2,1-3H3
InChIKey JOCKEOCKSBOIQA-UHFFFAOYSA-N
Molecular Weight 146.248 g/mol
SMILES C(=O)(SC)CCC(C)C
SPLASH splash10-000x-9000000000-cf10abf8be59af461092
Source of Spectrum W5-1989-33900-31636
Synonyms 4-Methylpentanethioic acid S-methyl ester
Wiley ID 1143974