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4-[(3'-Oxo-2'-{methoxycarbonyl}but-1'-enyl)amino]-1H-(1,2,3)-benzotriazole
SpectraBase Compound ID IHmgyObS7ir
InChI InChI=1S/C12H12N4O3/c1-7(17)8(12(18)19-2)6-13-9-4-3-5-10-11(9)15-16-14-10/h3-6,13H,1-2H3,(H,14,15,16)/b8-6+
InChIKey OEMFLKQXZVTOJE-SOFGYWHQSA-N
Mol Weight 260.25 g/mol
Molecular Formula C12H12N4O3
Exact Mass 260.09094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2WbxCJ9xrXd
Name 4-[(3'-Oxo-2'-{methoxycarbonyl}but-1'-enyl)amino]-1H-(1,2,3)-benzotriazole
Alternate Name(s) Methyl (2E)-2-acetyl-3-(1H-1,2,3-benzotriazol-4-ylamino)-2-propenoate
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Formula C12H12N4O3
InChI InChI=1S/C12H12N4O3/c1-7(17)8(12(18)19-2)6-13-9-4-3-5-10-11(9)15-16-14-10/h3-6,13H,1-2H3,(H,14,15,16)/b8-6+
InChIKey OEMFLKQXZVTOJE-SOFGYWHQSA-N
Molecular Weight 260.253 g/mol
SMILES N(\C=C\(C(=O)OC)C(=O)C)c1c2c([nH]nn2)ccc1
SPLASH splash10-0006-9000000000-71935942a5ed106d08cb
Source of Spectrum G-57-537-0
Wiley ID 813269