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(2E)-2-[2-(1,3-benzoxazol-2-ylamino)-4-oxo-1H-imidazol-5-ylidene]acetic acid methyl ester
SpectraBase Compound ID CgcG6ww1kVT
InChI InChI=1S/C13H10N4O4/c1-20-10(18)6-8-11(19)16-12(14-8)17-13-15-7-4-2-3-5-9(7)21-13/h2-6H,1H3,(H2,14,15,16,17,19)/b8-6+
InChIKey IORPOUNXICMTHS-SOFGYWHQSA-N
Mol Weight 286.25 g/mol
Molecular Formula C13H10N4O4
Exact Mass 286.070205 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LXVJJv71Rmb
Name (2E)-2-[2-(1,3-benzoxazol-2-ylamino)-4-oxo-1H-imidazol-5-ylidene]acetic acid methyl ester
Alternate Name(s) (2E)-2-[2-(1,3-benzoxazol-2-ylamino)-5-keto-2-imidazolin-4-ylidene]acetic acid methyl ester Methyl (2E)-2-[2-(1,3-benzoxazol-2-ylamino)-4-oxidanylidene-1H-imidazol-5-ylidene]ethanoate Methyl (2E)-2-[2-(1,3-benzoxazol-2-ylamino)-4-oxo-1H-imidazol-5-ylidene]acetate Methyl (2E)-[2-(1,3-benzoxazol-2-ylamino)-5-oxo-1,5-dihydro-4H-imidazol-4-ylidene]ethanoate
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Formula C13H10N4O4
InChI InChI=1S/C13H10N4O4/c1-20-10(18)6-8-11(19)16-12(14-8)17-13-15-7-4-2-3-5-9(7)21-13/h2-6H,1H3,(H2,14,15,16,17,19)/b8-6+
InChIKey IORPOUNXICMTHS-SOFGYWHQSA-N
Molecular Weight 286.247 g/mol
SMILES N1C(\C(N=C1Nc1nc2ccccc2o1)=C/C(=O)OC)=O
SPLASH splash10-000i-2940000000-deef7f066fa8f4a820e6
Wiley ID 1453016