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1H-imidazole-4,5-dicarboxylic acid
SpectraBase Compound ID AsFjwMMNZLg
InChI InChI=1S/C5H4N2O4/c8-4(9)2-3(5(10)11)7-1-6-2/h1H,(H,6,7)(H,8,9)(H,10,11)
InChIKey ZEVWQFWTGHFIDH-UHFFFAOYSA-N
Mol Weight 156.1 g/mol
Molecular Formula C5H4N2O4
Exact Mass 156.017107 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DTKo9og74x4
Name 4,5-Imidazoledicarboxylic acid
Alternate Name(s) .alpha.,.beta.-Imidazoledicarboxylic acid 1H-Imidazole-4,5-dicarboxylic acid 4,5-Dicarboxyimidazole 4,5-Imidazoledicarboxylate Glycoxalinedicarboxylic acid Glyoxalinedicarboxylic acid Imidazole-4,5-dicarboxylic acid AI3-52411 BRN 0147774 EINECS 209-327-5 NSC 9236
CAS Registry Number 570-22-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H4N2O4
InChI InChI=1S/C5H4N2O4/c8-4(9)2-3(5(10)11)7-1-6-2/h1H,(H,6,7)(H,8,9)(H,10,11)
InChIKey ZEVWQFWTGHFIDH-UHFFFAOYSA-N
Molecular Weight 156.097 g/mol
SMILES OC(c1nc[nH]c1C(=O)O)=O
SPLASH splash10-07do-9400000000-7deaa4034aa40cda846e
Source of Spectrum EK-1999-998-0
Wiley ID 1153075