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2-([4-(Benzoylamino)benzoyl]amino)terephthalic acid
SpectraBase Compound ID 6VViAPqJJeE
InChI InChI=1S/C22H16N2O6/c25-19(13-4-2-1-3-5-13)23-16-9-6-14(7-10-16)20(26)24-18-12-15(21(27)28)8-11-17(18)22(29)30/h1-12H,(H,23,25)(H,24,26)(H,27,28)(H,29,30)
InChIKey ORMBMIAXHZHUEQ-UHFFFAOYSA-N
Mol Weight 404.38 g/mol
Molecular Formula C22H16N2O6
Exact Mass 404.100836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5RCyb79fZzg
Name 2-([4-(Benzoylamino)benzoyl]amino)terephthalic acid
Alternate Name(s) 2-(4-Benzamidobenzamido)terephthalic acid 2-[(4-benzamidobenzoyl)amino]terephthalic acid 2-[(4-benzamidophenyl)carbonylamino]terephthalic acid 2-[[(4-benzamidophenyl)-oxomethyl]amino]terephthalic acid
CAS Registry Number 134291-87-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H16N2O6
InChI InChI=1S/C22H16N2O6/c25-19(13-4-2-1-3-5-13)23-16-9-6-14(7-10-16)20(26)24-18-12-15(21(27)28)8-11-17(18)22(29)30/h1-12H,(H,23,25)(H,24,26)(H,27,28)(H,29,30)
InChIKey ORMBMIAXHZHUEQ-UHFFFAOYSA-N
Molecular Weight 404.378 g/mol
SMILES N(C(c1ccc(cc1)NC(=O)c1ccccc1)=O)c1cc(C(=O)O)ccc1C(=O)O
SPLASH splash10-0a4i-5900000000-18a48e90911b6d3a7a55
Wiley ID 1470680