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1,3-dibenzyl-5-[3-(4-methoxyphenyl)phenyl]pyrimidine-2,4-dione
SpectraBase Compound ID JjlVLEzrhpR
InChI InChI=1S/C31H26N2O3/c1-36-28-17-15-25(16-18-28)26-13-8-14-27(19-26)29-22-32(20-23-9-4-2-5-10-23)31(35)33(30(29)34)21-24-11-6-3-7-12-24/h2-19,22H,20-21H2,1H3
InChIKey HCKCSURXYNRTJG-UHFFFAOYSA-N
Mol Weight 474.56 g/mol
Molecular Formula C31H26N2O3
Exact Mass 474.194343 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JM18hX1aXwv
Name 1,3-dibenzyl-5-[3-(4-methoxyphenyl)phenyl]pyrimidine-2,4-dione
Alternate Name(s) 1,3-dibenzyl-5-[3-(4-methoxyphenyl)phenyl]pyrimidine-2,4-quinone 5-[3-(4-methoxyphenyl)phenyl]-1,3-bis(phenylmethyl)pyrimidine-2,4-dione
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H26N2O3
InChI InChI=1S/C31H26N2O3/c1-36-28-17-15-25(16-18-28)26-13-8-14-27(19-26)29-22-32(20-23-9-4-2-5-10-23)31(35)33(30(29)34)21-24-11-6-3-7-12-24/h2-19,22H,20-21H2,1H3
InChIKey HCKCSURXYNRTJG-UHFFFAOYSA-N
Molecular Weight 474.560 g/mol
SMILES C1(N(C(C(=CN1Cc1ccccc1)c1cc(-c2ccc(cc2)OC)ccc1)=O)Cc1ccccc1)=O
SPLASH splash10-00dl-4000900000-019f54f78e2fbf121195
Source of Spectrum J-63-208-7
Wiley ID 1394027