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1H-1,2,3-Triazole-4-carboxylic acid, 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-ethyl-, ethyl ester
SpectraBase Compound ID ALNOt8MW7O8
InChI InChI=1S/C9H12N6O3/c1-3-5-6(9(16)17-4-2)11-14-15(5)8-7(10)12-18-13-8/h3-4H2,1-2H3,(H2,10,12)
InChIKey DJARTFOWJAPNSO-UHFFFAOYSA-N
Mol Weight 252.23 g/mol
Molecular Formula C9H12N6O3
Exact Mass 252.097088 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 78gmOdprioi
Name 1H-1,2,3-Triazole-4-carboxylic acid, 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-ethyl-, ethyl ester
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Formula C9H12N6O3
InChI InChI=1S/C9H12N6O3/c1-3-5-6(9(16)17-4-2)11-14-15(5)8-7(10)12-18-13-8/h3-4H2,1-2H3,(H2,10,12)
InChIKey DJARTFOWJAPNSO-UHFFFAOYSA-N
Molecular Weight 252.234 g/mol
SMILES Nc1c(-[n]2nnc(c2CC)C(OCC)=O)non1
SPLASH splash10-0f6w-9400000000-5700d037618d53fa07bd
Source of Spectrum IY-2-4769-1
Synonyms Ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-ethyl-1H-1,2,3-triazole-4-carboxylate 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-ethyl-4-triazolecarboxylic acid ethyl ester Ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-ethyltriazole-4-carboxylate Ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-ethyl-triazole-4-carboxylate Ethyl 1-(4-azanyl-1,2,5-oxadiazol-3-yl)-5-ethyl-1,2,3-triazole-4-carboxylate
Wiley ID 1655674