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

*Links on SpectraBase are not permalinks.
Pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione, 6,7-dihydro-1,3-dimethyl-6-(4-methylphenyl)-7-[(4-methylphenyl)imino]-
SpectraBase Compound ID AvrL3mD7h1c
InChI InChI=1S/C22H21N5O2/c1-14-5-9-16(10-6-14)23-21-24-19-18(20(28)26(4)22(29)25(19)3)13-27(21)17-11-7-15(2)8-12-17/h5-13H,1-4H3/b23-21+
InChIKey IKKSJOHYCFQVKQ-XTQSDGFTSA-N
Mol Weight 387.44 g/mol
Molecular Formula C22H21N5O2
Exact Mass 387.169525 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 7u7Ny4n4JsK
Name Pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione, 6,7-dihydro-1,3-dimethyl-6-(4-methylphenyl)-7-[(4-methylphenyl)imino]-
CAS Registry Number 132124-92-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H21N5O2
InChI InChI=1S/C22H21N5O2/c1-14-5-9-16(10-6-14)23-21-24-19-18(20(28)26(4)22(29)25(19)3)13-27(21)17-11-7-15(2)8-12-17/h5-13H,1-4H3/b23-21+
InChIKey IKKSJOHYCFQVKQ-XTQSDGFTSA-N
Molecular Weight 387.443 g/mol
SMILES C=12C(C(=O)N(C(N2C)=O)C)=CN(\C(N1)=N\c1ccc(cc1)C)c1ccc(cc1)C
SPLASH splash10-000i-1109000000-2e6907cd34e856328243
Source of Spectrum F-46-7861-4
Synonyms (7Z)-1,3-dimethyl-6-(4-methylphenyl)-7-[(4-methylphenyl)imino]-6,7-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione 7-(p-tolyl)imino-6-(p-tolyl)-1,3-dimethyl-2,4-dioxo-1,2,3,4,6,7-hexahydropyrimido[4,5-d]pyrimidine
Wiley ID 1363413