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3-methylthian-4-one
SpectraBase Compound ID 4vIB7TkAYMo
InChI InChI=1S/C6H10OS/c1-5-4-8-3-2-6(5)7/h5H,2-4H2,1H3
InChIKey RYXJDUOHUJITMN-UHFFFAOYSA-N
Mol Weight 130.2 g/mol
Molecular Formula C6H10OS
Exact Mass 130.045236 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IF4oeG47ZHm
Name 4H-Thiopyran-4-one, tetrahydro-3-methyl-
CAS Registry Number 38486-22-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H10OS
InChI InChI=1S/C6H10OS/c1-5-4-8-3-2-6(5)7/h5H,2-4H2,1H3
InChIKey RYXJDUOHUJITMN-UHFFFAOYSA-N
Molecular Weight 130.205 g/mol
SMILES C1(C(CSCC1)C)=O
SPLASH splash10-001r-9800000000-8ce4112bfd47e89e4666
Source of Spectrum J-52-1229-0
Synonyms 3-Methyl-4-thianone 3-Methyltetrahydrothiopyran-4-one 3-Methylthian-4-one
Wiley ID 1132402