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Butyl 5-amino-1H-1,2,4-triazole-3-carboxylate

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Butyl 5-amino-1H-1,2,4-triazole-3-carboxylate
SpectraBase Compound ID 7SfGQRpjgq6
InChI InChI=1S/C7H12N4O2/c1-2-3-4-13-6(12)5-9-7(8)11-10-5/h2-4H2,1H3,(H3,8,9,10,11)
InChIKey MJNHDRLUMGNWBJ-UHFFFAOYSA-N
Mol Weight 184.2 g/mol
Molecular Formula C7H12N4O2
Exact Mass 184.096026 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JH3NZcs0AMz
Name Butyl 5-amino-1H-1,2,4-triazole-3-carboxylate
CAS Registry Number 297149-37-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12N4O2
InChI InChI=1S/C7H12N4O2/c1-2-3-4-13-6(12)5-9-7(8)11-10-5/h2-4H2,1H3,(H3,8,9,10,11)
InChIKey MJNHDRLUMGNWBJ-UHFFFAOYSA-N
Molecular Weight 184.199 g/mol
SMILES Nc1nc(n[nH]1)C(OCCCC)=O
SPLASH splash10-01tc-8900000000-11898328d1aafa4b7dad
Synonyms 3-Amino-1H-1,2,4-triazole-5-carboxylic acid butyl ester 5-Amino-1H-[1,2,4]triazole-3-carboxylic acid butyl ester Butyl 3-amino-1H-1,2,4-triazole-5-carboxylate Butyl 3-azanyl-1H-1,2,4-triazole-5-carboxylate
Wiley ID 1458040