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4,5-Dimethoxy-2-[(2-methyl-3-nitro-phenyl)carbonylamino]benzoic acid
SpectraBase Compound ID KWTq0sUGKQ9
InChI InChI=1S/C17H16N2O7/c1-9-10(5-4-6-13(9)19(23)24)16(20)18-12-8-15(26-3)14(25-2)7-11(12)17(21)22/h4-8H,1-3H3,(H,18,20)(H,21,22)
InChIKey LKUSCKCPCPINEK-UHFFFAOYSA-N
Mol Weight 360.32 g/mol
Molecular Formula C17H16N2O7
Exact Mass 360.095751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2nP1OvwIdqM
Name 4,5-Dimethoxy-2-[(2-methyl-3-nitro-phenyl)carbonylamino]benzoic acid
Alternate Name(s) 4,5-Dimethoxy-2-[[(2-methyl-3-nitrophenyl)-oxomethyl]amino]benzoic acid 4,5-Dimethoxy-2-[(2-methyl-3-nitrobenzoyl)amino]benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16N2O7
InChI InChI=1S/C17H16N2O7/c1-9-10(5-4-6-13(9)19(23)24)16(20)18-12-8-15(26-3)14(25-2)7-11(12)17(21)22/h4-8H,1-3H3,(H,18,20)(H,21,22)
InChIKey LKUSCKCPCPINEK-UHFFFAOYSA-N
Molecular Weight 360.322 g/mol
SMILES N(C(c1c(c(N(=O)=O)ccc1)C)=O)c1c(C(=O)O)cc(c(c1)OC)OC
SPLASH splash10-03di-7901000000-822bb9595249a627d402
Wiley ID 1442745