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4-cyano-1-methyl-1H-imidazole-5-carboxylic acid
SpectraBase Compound ID 8SZKimR2898
InChI InChI=1S/C6H5N3O2/c1-9-3-8-4(2-7)5(9)6(10)11/h3H,1H3,(H,10,11)
InChIKey ZKRPZVXOCOLIFW-UHFFFAOYSA-N
Mol Weight 151.12 g/mol
Molecular Formula C6H5N3O2
Exact Mass 151.038176 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bm0hQeK239
Name 4-cyano-1-methyl-1H-imidazole-5-carboxylic acid
Alternate Name(s) 5-cyano-3-methyl-4-imidazolecarboxylic acid 5-cyano-3-methyl-imidazole-4-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H5N3O2
InChI InChI=1S/C6H5N3O2/c1-9-3-8-4(2-7)5(9)6(10)11/h3H,1H3,(H,10,11)
InChIKey ZKRPZVXOCOLIFW-UHFFFAOYSA-N
Molecular Weight 151.125 g/mol
SMILES OC(c1c(nc[n]1C)C#N)=O
SPLASH splash10-052f-9600000000-dcb4a4454e8122774420
Source of Spectrum F-50-2652-5
Wiley ID 1147982