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3-Nitro-benzoic acid 2-(4-nitro-phenyl)-2-oxo-ethyl ester
SpectraBase Compound ID DqBYTNSZDRb
InChI InChI=1S/C15H10N2O7/c18-14(10-4-6-12(7-5-10)16(20)21)9-24-15(19)11-2-1-3-13(8-11)17(22)23/h1-8H,9H2
InChIKey PYBSIBCDNSNMBV-UHFFFAOYSA-N
Mol Weight 330.25 g/mol
Molecular Formula C15H10N2O7
Exact Mass 330.048801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DApwg5kxYI
Name 3-Nitro-benzoic acid 2-(4-nitro-phenyl)-2-oxo-ethyl ester
Alternate Name(s) 3-Nitrobenzoic acid [2-(4-nitrophenyl)-2-oxoethyl] ester [2-(4-nitrophenyl)-2-oxoethyl] 3-nitrobenzoate [2-(4-nitrophenyl)-2-oxo-ethyl] 3-nitrobenzoate [2-(4-nitrophenyl)-2-oxidanylidene-ethyl] 3-nitrobenzoate
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Formula C15H10N2O7
InChI InChI=1S/C15H10N2O7/c18-14(10-4-6-12(7-5-10)16(20)21)9-24-15(19)11-2-1-3-13(8-11)17(22)23/h1-8H,9H2
InChIKey PYBSIBCDNSNMBV-UHFFFAOYSA-N
Molecular Weight 330.252 g/mol
SMILES c1cc(C(OCC(c2ccc(N(=O)=O)cc2)=O)=O)cc(N(=O)=O)c1
SPLASH splash10-0f6t-2902000000-6da17226230264748d92
Wiley ID 1453997