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2-Hydroxy-3,6-dioxo-1,4-cyclohexadiene-1-carboxylic acid
SpectraBase Compound ID EO55Hc7VQLX
InChI InChI=1S/C7H4O5/c8-3-1-2-4(9)6(10)5(3)7(11)12/h1-2,10H,(H,11,12)
InChIKey RTSNVAJPNOPZED-UHFFFAOYSA-N
Mol Weight 168.1 g/mol
Molecular Formula C7H4O5
Exact Mass 168.005873 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CCi7xndPayI
Name 2-Hydroxy-3,6-dioxo-1,4-cyclohexadiene-1-carboxylic acid
CAS Registry Number 92544-13-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H4O5
InChI InChI=1S/C7H4O5/c8-3-1-2-4(9)6(10)5(3)7(11)12/h1-2,10H,(H,11,12)
InChIKey RTSNVAJPNOPZED-UHFFFAOYSA-N
Molecular Weight 168.104 g/mol
SMILES OC1=C(C(=O)O)C(C=CC1=O)=O
SPLASH splash10-001r-5900000000-b24982aa58ce95fa7267
Source of Spectrum J-49-4737-0
Synonyms 2-Hydroxy-3,6-dioxo-1-cyclohexa-1,4-dienecarboxylic acid 2-Hydroxy-3,6-dioxocyclohexa-1,4-diene-1-carboxylic acid 2-Hydroxy-3,6-dioxo-cyclohexa-1,4-diene-1-carboxylic acid 2-Oxidanyl-3,6-bis(oxidanylidene)cyclohexa-1,4-diene-1-carboxylic acid
Wiley ID 1163992