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5-methylthiophen-3-one
SpectraBase Compound ID BfvO8lK5iQM
InChI InChI=1S/C5H6OS/c1-4-2-5(6)3-7-4/h2H,3H2,1H3
InChIKey ZFBVNLODJBMXPQ-UHFFFAOYSA-N
Mol Weight 114.16 g/mol
Molecular Formula C5H6OS
Exact Mass 114.013936 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6yFQibOEUde
Name 5-Methyl-3(2H)-thiophenone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H6OS
InChI InChI=1S/C5H6OS/c1-4-2-5(6)3-7-4/h2H,3H2,1H3
InChIKey ZFBVNLODJBMXPQ-UHFFFAOYSA-N
Molecular Weight 114.162 g/mol
SMILES C1=C(SCC1=O)C
SPLASH splash10-03dj-9600000000-98c7c530ebe8065bc80d
Source of Spectrum KC-0-1213-31
Synonyms 5-Methyl-3-thiophenone 5-Methylthiophen-3-one
Wiley ID 783713