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Benzoic acid, 4-nitro-, 4-(ethoxycarbonylhydrazonomethyl)phenyl ester
SpectraBase Compound ID 5yrsbG1QEyr
InChI InChI=1S/C17H15N3O6/c1-2-25-17(22)19-18-11-12-3-9-15(10-4-12)26-16(21)13-5-7-14(8-6-13)20(23)24/h3-11H,2H2,1H3,(H,19,22)/b18-11+
InChIKey DMGOOHUTDRIFHA-WOJGMQOQSA-N
Mol Weight 357.32 g/mol
Molecular Formula C17H15N3O6
Exact Mass 357.096085 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B9jiNGHjqEQ
Name Benzoic acid, 4-nitro-, 4-(ethoxycarbonylhydrazonomethyl)phenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 357.096085209 u
Formula C17H15N3O6
InChI InChI=1S/C17H15N3O6/c1-2-25-17(22)19-18-11-12-3-9-15(10-4-12)26-16(21)13-5-7-14(8-6-13)20(23)24/h3-11H,2H2,1H3,(H,19,22)/b18-11+
InChIKey DMGOOHUTDRIFHA-WOJGMQOQSA-N
Molecular Weight 357.322 g/mol
SMILES CCOC(N\N=C\C1=CC=C(OC(C2=CC=C(N(=O)=O)C=C2)=O)C=C1)=O