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(3S)-3-Carboxybutano-4-lactone [(S)-(-)-paraconic acid]
SpectraBase Compound ID 3tyETNcmHjc
InChI InChI=1S/C5H6O4/c6-4-1-3(2-9-4)5(7)8/h3H,1-2H2,(H,7,8)/t3-/m0/s1
InChIKey ONSWFYLALGXCIQ-VKHMYHEASA-N
Mol Weight 130.1 g/mol
Molecular Formula C5H6O4
Exact Mass 130.026609 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 31YJD7nHwzY
Name (3S)-3-Carboxybutano-4-lactone [(S)-(-)-paraconic acid]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H6O4
InChI InChI=1S/C5H6O4/c6-4-1-3(2-9-4)5(7)8/h3H,1-2H2,(H,7,8)/t3-/m0/s1
InChIKey ONSWFYLALGXCIQ-VKHMYHEASA-N
Molecular Weight 130.099 g/mol
SMILES OC([C@]1(CC(=O)OC1)[H])=O
SPLASH splash10-0a4i-9200000000-96555d0598b07ccb3222
Source of Spectrum KC-0-1724-2
Synonyms (3S)-5-oxotetrahydro-3-furancarboxylic acid 3-Furancarboxylic acid, tetrahydro-5-oxo-, (3S)- (3S)-5-oxo-3-oxolanecarboxylic acid (3S)-5-oxooxolane-3-carboxylic acid (3S)-5-oxotetrahydrofuran-3-carboxylic acid (3S)-5-oxidanylideneoxolane-3-carboxylic acid
Wiley ID 825500