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N-(4-(2-hydroxy-6-(4-methoxyphenyl)pyrimidin-4-yl)phenyl)-4-methylbenzamide
SpectraBase Compound ID EdDVJsGUYny
InChI InChI=1S/C25H21N3O3/c1-16-3-5-19(6-4-16)24(29)26-20-11-7-17(8-12-20)22-15-23(28-25(30)27-22)18-9-13-21(31-2)14-10-18/h3-15H,1-2H3,(H,26,29)(H,27,28,30)
InChIKey REJORPZJOWIULS-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 Dm1tbkubK6V
Name N-(4-(2-hydroxy-6-(4-methoxyphenyl)pyrimidin-4-yl)phenyl)-4-methylbenzamide
Appearance Orange-Red powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H21N3O3
InChI InChI=1S/C25H21N3O3/c1-16-3-5-19(6-4-16)24(29)26-20-11-7-17(8-12-20)22-15-23(28-25(30)27-22)18-9-13-21(31-2)14-10-18/h3-15H,1-2H3,(H,26,29)(H,27,28,30)
InChIKey REJORPZJOWIULS-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/cbdv.202200231
Molecular Weight 411.461 g/mol
SMILES Oc1nc(cc(-c2ccc(cc2)NC(c2ccc(cc2)C)=O)n1)-c1ccc(cc1)OC
SPLASH splash10-067l-9400000000-7add3fa704e50cf539a3
Source of Spectrum CBD-19-SM56-4s
Wiley ID 1882722