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1H-1,2,4-Triazole-3-carboxylic acid, 5-amino-, ethyl ester
SpectraBase Compound ID FgAPN1dy6FE
InChI InChI=1S/C5H8N4O2/c1-2-11-4(10)3-7-5(6)9-8-3/h2H2,1H3,(H3,6,7,8,9)
InChIKey MLVNUTAJXZZPCJ-UHFFFAOYSA-N
Mol Weight 156.15 g/mol
Molecular Formula C5H8N4O2
Exact Mass 156.064726 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E3VMmUq4fHC
Name 1H-1,2,4-Triazole-3-carboxylic acid, 5-amino-, ethyl ester
CAS Registry Number 63666-11-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H8N4O2
InChI InChI=1S/C5H8N4O2/c1-2-11-4(10)3-7-5(6)9-8-3/h2H2,1H3,(H3,6,7,8,9)
InChIKey MLVNUTAJXZZPCJ-UHFFFAOYSA-N
Molecular Weight 156.145 g/mol
SMILES Nc1nnc(C(OCC)=O)[nH]1
SPLASH splash10-004i-9400000000-0983c46cd03d2167b924
Source of Spectrum JX-2012-2
Synonyms 5-Amino-4H-[1,2,4]triazole-3-carboxylic acid ethyl ester Ethyl 3-amino-1H-1,2,4-triazole-5-carboxylate Ethyl 5-amino-1H-1,2,4-triazole-3-carboxylate Ethyl 5-amino-4H-[1,2,4]triazole-3-carboxylate Ethyl 3-azanyl-1H-1,2,4-triazole-5-carboxylate
Wiley ID 1660450