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4-Oxopentanethioic acid
SpectraBase Compound ID HN3Zm1TbcHN
InChI InChI=1S/C5H8O2S/c1-4(6)2-3-5(7)8/h2-3H2,1H3,(H,7,8)
InChIKey ZGVDOBRDNWJNDJ-UHFFFAOYSA-N
Mol Weight 132.18 g/mol
Molecular Formula C5H8O2S
Exact Mass 132.024501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4yXJgLdYQjY
Name 4-Oxopentanethioic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H8O2S
InChI InChI=1S/C5H8O2S/c1-4(6)2-3-5(7)8/h2-3H2,1H3,(H,7,8)
InChIKey ZGVDOBRDNWJNDJ-UHFFFAOYSA-N
Molecular Weight 132.177 g/mol
SMILES SC(CCC(C)=O)=O
SPLASH splash10-0006-9000000000-6e936422a47e0a2ea110
Synonyms 4-ketothiovaleric acid 4-Oxidanylidenepentanethioic S-acid 4-Oxopentanethioic S-acid
Wiley ID 1481404