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3-ACETYLTETRONIC-ACID;TAUTOMER-AB
SpectraBase Compound ID C7EmcP8i011
InChI InChI=1S/C6H6O4/c1-3(7)5-4(8)2-10-6(5)9/h8H,2H2,1H3
InChIKey CQLZBFDISXGMOK-UHFFFAOYSA-N
Mol Weight 142.11 g/mol
Molecular Formula C6H6O4
Exact Mass 142.026609 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KT6kedEdR17
Name 2(5H)-Furanone, 3-acetyl-4-hydroxy-
CAS Registry Number 22621-26-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H6O4
InChI InChI=1S/C6H6O4/c1-3(7)5-4(8)2-10-6(5)9/h8H,2H2,1H3
InChIKey CQLZBFDISXGMOK-UHFFFAOYSA-N
Molecular Weight 142.110 g/mol
SMILES OC1=C(C(OC1)=O)C(=O)C
SPLASH splash10-0006-9300000000-347c53bcd51e7ddaf591
Source of Spectrum T-68-549-0
Synonyms 3-Acetyl-4-hydroxy-2(5H)-furanone .alpha.-acetyltetronic acid 2-Acetyltetronic acid 4-Acetyl-5-hydroxy-3(2H)-furanone 4-Acetyl-5-hydroxy-3-furanone 4-Acetyl-5-hydroxy-furan-3-one 4-Ethanoyl-5-oxidanyl-furan-3-one
Wiley ID 8115