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2-(4-(4-Nitrophenyl)-6-phenyl-2-pyrimidinylamino)benzoic acid methyl ester
SpectraBase Compound ID Iyeuub9EjNC
InChI InChI=1S/C24H18N4O4/c1-32-23(29)19-9-5-6-10-20(19)25-24-26-21(16-7-3-2-4-8-16)15-22(27-24)17-11-13-18(14-12-17)28(30)31/h2-15H,1H3,(H,25,26,27)
InChIKey PXAMEXZBKFQCRD-UHFFFAOYSA-N
Mol Weight 426.43 g/mol
Molecular Formula C24H18N4O4
Exact Mass 426.132805 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fti0bZIFKnp
Name 2-(2-carbomethoxyphenylamino)-4-phenyl-6-(4-nitrophenyl)pyrimidine
Alternate Name(s) Methyl 2-{[4-(4-nitrophenyl)-6-phenyl-2-pyrimidinyl]amino}benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H18N4O4
InChI InChI=1S/C24H18N4O4/c1-32-23(29)19-9-5-6-10-20(19)25-24-26-21(16-7-3-2-4-8-16)15-22(27-24)17-11-13-18(14-12-17)28(30)31/h2-15H,1H3,(H,25,26,27)
InChIKey PXAMEXZBKFQCRD-UHFFFAOYSA-N
Molecular Weight 426.432 g/mol
SMILES N(c1nc(-c2ccc(N(=O)=O)cc2)cc(n1)-c1ccccc1)c1c(C(=O)OC)cccc1
SPLASH splash10-014i-0009100000-8fcf1ae475093cd329d9
Source of Spectrum SS-5-143-0
Wiley ID 1379940