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1-Acetyl-5-amino-1,2,4-triazole-3-carboxylic acid methyl ester
SpectraBase Compound ID BnnJJWs5yzk
InChI InChI=1S/C6H8N4O3/c1-3(11)10-6(7)8-4(9-10)5(12)13-2/h1-2H3,(H2,7,8,9)
InChIKey ZLUARKDUOPJRAD-UHFFFAOYSA-N
Mol Weight 184.16 g/mol
Molecular Formula C6H8N4O3
Exact Mass 184.05964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FgSEjZhHVMh
Name 1-Acetyl-5-amino-1,2,4-triazole-3-carboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H8N4O3
InChI InChI=1S/C6H8N4O3/c1-3(11)10-6(7)8-4(9-10)5(12)13-2/h1-2H3,(H2,7,8,9)
InChIKey ZLUARKDUOPJRAD-UHFFFAOYSA-N
Molecular Weight 184.155 g/mol
SMILES Nc1[n](nc(n1)C(=O)OC)C(=O)C
SPLASH splash10-0006-1900000000-fc365f4071fcae96c91e
Source of Spectrum E2-52-198-3
Synonyms Methyl 1-acetyl-5-amino-1,2,4-triazole-3-carboxylate Methyl 5-azanyl-1-ethanoyl-1,2,4-triazole-3-carboxylate
Wiley ID 1556373