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1H-Imidazole-4,5-dicarboxylic acid, 1-(2-oxopropyl)-
SpectraBase Compound ID Aja02CdoRpx
InChI InChI=1S/C8H8N2O5/c1-4(11)2-10-3-9-5(7(12)13)6(10)8(14)15/h3H,2H2,1H3,(H,12,13)(H,14,15)
InChIKey XHUXGPZKYVGNRE-UHFFFAOYSA-N
Mol Weight 212.16 g/mol
Molecular Formula C8H8N2O5
Exact Mass 212.043321 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3jnZ6hkwYlw
Name 1H-Imidazole-4,5-dicarboxylic acid, 1-(2-oxopropyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8N2O5
InChI InChI=1S/C8H8N2O5/c1-4(11)2-10-3-9-5(7(12)13)6(10)8(14)15/h3H,2H2,1H3,(H,12,13)(H,14,15)
InChIKey XHUXGPZKYVGNRE-UHFFFAOYSA-N
Molecular Weight 212.161 g/mol
SMILES OC(c1c(C(=O)O)[n](cn1)CC(=O)C)=O
SPLASH splash10-0uk9-4900000000-80404c9bb6cc32ebb6b5
Source of Spectrum IY-1-4314-7
Synonyms 1-(2-oxopropyl)imidazole-4,5-dicarboxylic acid 1-(2-oxidanylidenepropyl)imidazole-4,5-dicarboxylic acid
Wiley ID 1651130