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2-[(4-Acetylanilino)carbonyl]-4-nitrobenzoic acid
SpectraBase Compound ID 9z22NBxN4fx
InChI InChI=1S/C16H12N2O6/c1-9(19)10-2-4-11(5-3-10)17-15(20)14-8-12(18(23)24)6-7-13(14)16(21)22/h2-8H,1H3,(H,17,20)(H,21,22)
InChIKey LYCJCGWRLBOZBZ-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 HowdCTFFVl8
Name 2-[(4-Acetylanilino)carbonyl]-4-nitrobenzoic acid
Alternate Name(s) 2-[(4-acetylanilino)-oxomethyl]-4-nitrobenzoic acid 2-[(4-acetylphenyl)carbamoyl]-4-nitro-benzoic acid 2-[(4-ethanoylphenyl)carbamoyl]-4-nitro-benzoic acid
CAS Registry Number 300727-78-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12N2O6
InChI InChI=1S/C16H12N2O6/c1-9(19)10-2-4-11(5-3-10)17-15(20)14-8-12(18(23)24)6-7-13(14)16(21)22/h2-8H,1H3,(H,17,20)(H,21,22)
InChIKey LYCJCGWRLBOZBZ-UHFFFAOYSA-N
Molecular Weight 328.280 g/mol
SMILES N(C(c1cc(ccc1C(=O)O)N(=O)=O)=O)c1ccc(cc1)C(=O)C
SPLASH splash10-002f-9210000000-f43e5ccf77d9de1857b6
Wiley ID 1468758