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3-Penten-2-one, 3-phenyl-, o(4-nitrobenzoyl)oxime
SpectraBase Compound ID 2NQ2J9k1Y7N
InChI InChI=1S/C18H16N2O4/c1-3-17(14-7-5-4-6-8-14)13(2)19-24-18(21)15-9-11-16(12-10-15)20(22)23/h3-12H,1-2H3/b17-3-,19-13+
InChIKey ZWWQYSSOMBRKHE-MTJFTAEOSA-N
Mol Weight 324.34 g/mol
Molecular Formula C18H16N2O4
Exact Mass 324.111007 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JS5ZeW9HmPn
Name 3-Penten-2-one, 3-phenyl-, o(4-nitrobenzoyl)oxime
Alternate Name(s) 4-Nitrobenzoic acid [(E)-[(E)-3-phenylpent-3-en-2-ylidene]amino] ester [(E)-[(E)-1-methyl-2-phenyl-but-2-enylidene]amino] 4-nitrobenzoate [(E)-[(E)-3-phenylpent-3-en-2-ylidene]amino] 4-nitrobenzoate
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Formula C18H16N2O4
InChI InChI=1S/C18H16N2O4/c1-3-17(14-7-5-4-6-8-14)13(2)19-24-18(21)15-9-11-16(12-10-15)20(22)23/h3-12H,1-2H3/b17-3-,19-13+
InChIKey ZWWQYSSOMBRKHE-MTJFTAEOSA-N
Molecular Weight 324.336 g/mol
SMILES c1ccc(\C(\C(=N\OC(c2ccc(N(=O)=O)cc2)=O)C)=C/C)cc1
SPLASH splash10-0gb9-4900000000-ee8b4367f1bb93251087
Wiley ID 1437822