For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-benzyl-5-methyl-4-methylene-3,6-diphenyl-pyrimido[4,5-d]pyrimidine-2,7-dione
SpectraBase Compound ID EXmjSuk1xbH
InChI InChI=1S/C27H22N4O2/c1-19-24-20(2)31(23-16-10-5-11-17-23)27(33)29(18-21-12-6-3-7-13-21)25(24)28-26(32)30(19)22-14-8-4-9-15-22/h3-17H,2,18H2,1H3
InChIKey UYGONZPOMMFUFM-UHFFFAOYSA-N
Mol Weight 434.5 g/mol
Molecular Formula C27H22N4O2
Exact Mass 434.174276 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 1WtDeVHt0eK
Name 1-benzyl-5-methyl-4-methylene-3,6-diphenyl-pyrimido[4,5-d]pyrimidine-2,7-dione
Alternate Name(s) 1-benzyl-5-methyl-4-methylene-3,6-diphenyl-pyrimido[4,5-d]pyrimidine-2,7-quinone 1-benzyl-5-methyl-4-methylidene-3,6-diphenylpyrimido[4,5-d]pyrimidine-2,7-dione 5-methyl-4-methylene-3,6-diphenyl-1-(phenylmethyl)pyrimido[4,5-d]pyrimidine-2,7-dione 5-methyl-4-methylidene-3,6-diphenyl-1-(phenylmethyl)pyrimido[4,5-d]pyrimidine-2,7-dione
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H22N4O2
InChI InChI=1S/C27H22N4O2/c1-19-24-20(2)31(23-16-10-5-11-17-23)27(33)29(18-21-12-6-3-7-13-21)25(24)28-26(32)30(19)22-14-8-4-9-15-22/h3-17H,2,18H2,1H3
InChIKey UYGONZPOMMFUFM-UHFFFAOYSA-N
Molecular Weight 434.499 g/mol
SMILES C=12N(C(=O)N(C(C2=C(C)N(C(N1)=O)c1ccccc1)=C)c1ccccc1)Cc1ccccc1
SPLASH splash10-0006-0009300000-8fbf476ff6f3e68ca76c
Source of Spectrum F9-1991-2598-0
Wiley ID 1566528