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1H-1,2,4-Triazole-5-acetic acid, 3-amino-, ethyl ester
SpectraBase Compound ID KATU5KzyvcF
InChI InChI=1S/C6H10N4O2/c1-2-12-5(11)3-4-8-6(7)10-9-4/h2-3H2,1H3,(H3,7,8,9,10)
InChIKey NWORJPBMFMZKAQ-UHFFFAOYSA-N
Mol Weight 170.17 g/mol
Molecular Formula C6H10N4O2
Exact Mass 170.080376 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F7dP7WUl7T5
Name 1H-1,2,4-Triazole-5-acetic acid, 3-amino-, ethyl ester
Alternate Name(s) Ethyl 2-(3-amino-1H-1,2,4-triazol-5-yl)acetate Ethyl 2-(3-azanyl-1H-1,2,4-triazol-5-yl)ethanoate
CAS Registry Number 86152-46-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H10N4O2
InChI InChI=1S/C6H10N4O2/c1-2-12-5(11)3-4-8-6(7)10-9-4/h2-3H2,1H3,(H3,7,8,9,10)
InChIKey NWORJPBMFMZKAQ-UHFFFAOYSA-N
Molecular Weight 170.172 g/mol
SMILES [nH]1nc(nc1CC(OCC)=O)N
SPLASH splash10-006w-9300000000-d9403714cbb441a68e16
Source of Spectrum IY-2-4927-1
Wiley ID 1657254