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2-(4-(4-Methoxyphenyl)-6-phenyl-2-pyrimidinylamino)benzoic acid methyl ester
SpectraBase Compound ID AwnE0FDLYt8
InChI InChI=1S/C25H21N3O3/c1-30-19-14-12-18(13-15-19)23-16-22(17-8-4-3-5-9-17)27-25(28-23)26-21-11-7-6-10-20(21)24(29)31-2/h3-16H,1-2H3,(H,26,27,28)
InChIKey LSOQQYIGHRFRBM-UHFFFAOYSA-N
Mol Weight 411.46 g/mol
Molecular Formula C25H21N3O3
Exact Mass 411.158292 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GspdcnJKVk7
Name 2-(4-(4-Methoxyphenyl)-6-phenyl-2-pyrimidinylamino)benzoic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H21N3O3
InChI InChI=1S/C25H21N3O3/c1-30-19-14-12-18(13-15-19)23-16-22(17-8-4-3-5-9-17)27-25(28-23)26-21-11-7-6-10-20(21)24(29)31-2/h3-16H,1-2H3,(H,26,27,28)
InChIKey LSOQQYIGHRFRBM-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 411.461 g/mol
SMILES N(c1nc(cc(-c2ccc(OC)cc2)n1)-c1ccccc1)c1ccccc1C(=O)OC
SPLASH splash10-0udi-0009100000-9b4ab4d4c1d4c0706028
Source of Spectrum SRH-2022-5081-0
Wiley ID 1827202