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2-[(4-Acetylanilino)carbonyl]-5-nitrobenzoic acid
SpectraBase Compound ID IL9MzsAgbiB
InChI InChI=1S/C16H12N2O6/c1-9(19)10-2-4-11(5-3-10)17-15(20)13-7-6-12(18(23)24)8-14(13)16(21)22/h2-8H,1H3,(H,17,20)(H,21,22)
InChIKey JNNLQFCXBDUTIM-UHFFFAOYSA-N
Mol Weight 328.28 g/mol
Molecular Formula C16H12N2O6
Exact Mass 328.069536 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6lc4O3jqyyq
Name 2-[(4-Acetylanilino)carbonyl]-5-nitrobenzoic acid
Alternate Name(s) 2-[(4-acetylanilino)-oxomethyl]-5-nitrobenzoic acid 2-[(4-acetylphenyl)carbamoyl]-5-nitro-benzoic acid 2-[(4-ethanoylphenyl)carbamoyl]-5-nitro-benzoic acid 4'-Acetyl-5-nitrophthalanilic acid
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Formula C16H12N2O6
InChI InChI=1S/C16H12N2O6/c1-9(19)10-2-4-11(5-3-10)17-15(20)13-7-6-12(18(23)24)8-14(13)16(21)22/h2-8H,1H3,(H,17,20)(H,21,22)
InChIKey JNNLQFCXBDUTIM-UHFFFAOYSA-N
Molecular Weight 328.280 g/mol
SMILES N(C(c1ccc(cc1C(=O)O)N(=O)=O)=O)c1ccc(cc1)C(=O)C
SPLASH splash10-00fv-9310000000-7aa9f344f0aa058cfc1d
Wiley ID 1467436