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2-Methyl-1H-imidazole-4-carboxylic acid
SpectraBase Compound ID JWjbaFazs9q
InChI InChI=1S/C5H6N2O2/c1-3-6-2-4(7-3)5(8)9/h2H,1H3,(H,6,7)(H,8,9)
InChIKey DTUIYOVMTFYCBZ-UHFFFAOYSA-N
Mol Weight 126.11 g/mol
Molecular Formula C5H6N2O2
Exact Mass 126.042927 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A08muiVHf8O
Name 2-Methyl-1H-imidazole-4-carboxylic acid
Alternate Name(s) 1H-Imidazole-4-carboxylic acid, 2-methyl- 2-Methyl-1H-imidazole-5-carboxylic acid 2-Methylimidazole-4-carboxylic acid EINECS 215-943-5 NSC 109147
CAS Registry Number 1457-58-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H6N2O2
InChI InChI=1S/C5H6N2O2/c1-3-6-2-4(7-3)5(8)9/h2H,1H3,(H,6,7)(H,8,9)
InChIKey DTUIYOVMTFYCBZ-UHFFFAOYSA-N
Molecular Weight 126.115 g/mol
SMILES [nH]1c(nc(C(=O)O)c1)C
SPLASH splash10-0kc6-9300000000-5f829c841250ffb2869c
Source of Spectrum AD-0-2532-0
Wiley ID 1418969