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4-[(4-amino-1,2,5-oxadiazol-3-yl)amino]-4-oxobutanoic acid
SpectraBase Compound ID D8FMywuASVf
InChI InChI=1S/C6H8N4O4/c7-5-6(10-14-9-5)8-3(11)1-2-4(12)13/h1-2H2,(H2,7,9)(H,12,13)(H,8,10,11)
InChIKey CWIXTVNHEPWQMH-UHFFFAOYSA-N
Mol Weight 200.15 g/mol
Molecular Formula C6H8N4O4
Exact Mass 200.054555 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 92FqcMIWD1P
Name 4-[(4-amino-1,2,5-oxadiazol-3-yl)amino]-4-oxobutanoic acid
CAS Registry Number 329071-02-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H8N4O4
InChI InChI=1S/C6H8N4O4/c7-5-6(10-14-9-5)8-3(11)1-2-4(12)13/h1-2H2,(H2,7,9)(H,12,13)(H,8,10,11)
InChIKey CWIXTVNHEPWQMH-UHFFFAOYSA-N
Molecular Weight 200.154 g/mol
SMILES N(c1nonc1N)C(CCC(O)=O)=O
SPLASH splash10-006x-9100000000-3b797dbf640bfdd1b71f
Synonyms 4-[(4-aminofurazan-3-yl)amino]-4-keto-butyric acid 4-[(4-azanyl-1,2,5-oxadiazol-3-yl)amino]-4-oxidanylidene-butanoic acid
Wiley ID 1454292