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3,3-Dimethyl-2-oxobutyl 4-amino-1,2,5-oxadiazole-3-carboxylate
SpectraBase Compound ID 5OrNUKPZKrO
InChI InChI=1S/C9H13N3O4/c1-9(2,3)5(13)4-15-8(14)6-7(10)12-16-11-6/h4H2,1-3H3,(H2,10,12)
InChIKey GCIWICFINLMKLE-UHFFFAOYSA-N
Mol Weight 227.22 g/mol
Molecular Formula C9H13N3O4
Exact Mass 227.090606 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DOWVM9VVbkD
Name 3,3-Dimethyl-2-oxobutyl 4-amino-1,2,5-oxadiazole-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13N3O4
InChI InChI=1S/C9H13N3O4/c1-9(2,3)5(13)4-15-8(14)6-7(10)12-16-11-6/h4H2,1-3H3,(H2,10,12)
InChIKey GCIWICFINLMKLE-UHFFFAOYSA-N
Molecular Weight 227.220 g/mol
SMILES Nc1c(non1)C(=O)OCC(=O)C(C)(C)C
SPLASH splash10-0a4i-9000000000-5a0e8b9162dde4b64e05
Synonyms (3,3-dimethyl-2-oxidanylidene-butyl) 4-azanyl-1,2,5-oxadiazole-3-carboxylate 4-Amino-1,2,5-oxadiazole-3-carboxylic acid (3,3-dimethyl-2-oxobutyl) ester 4-Aminofurazan-3-carboxylic acid (2-keto-3,3-dimethyl-butyl) ester 4-Aminofurazan-3-carboxylic acid, 3,3-dimethyl-2-oxobutyl ester (3,3-dimethyl-2-oxobutyl) 4-amino-1,2,5-oxadiazole-3-carboxylate
Wiley ID 1439454