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

*Links on SpectraBase are not permalinks.
3-Methyl-2-(methylthio)-7(S)-phenyl-6-((R)-1-phenylethyl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(3H)-one
SpectraBase Compound ID 52kmEJW7KC
InChI InChI=1S/C22H24N4OS/c1-15(16-10-6-4-7-11-16)26-14-18-19(24-22(28-3)25(2)21(18)27)23-20(26)17-12-8-5-9-13-17/h4-13,15,20,23H,14H2,1-3H3/t15-,20+/m1/s1
InChIKey RWQBYZIVBZBWEC-QRWLVFNGSA-N
Mol Weight 392.52 g/mol
Molecular Formula C22H24N4OS
Exact Mass 392.167083 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 EfMm3Z9pMau
Name 3-Methyl-2-(methylthio)-7(S)-phenyl-6-((R)-1-phenylethyl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24N4OS
InChI InChI=1S/C22H24N4OS/c1-15(16-10-6-4-7-11-16)26-14-18-19(24-22(28-3)25(2)21(18)27)23-20(26)17-12-8-5-9-13-17/h4-13,15,20,23H,14H2,1-3H3/t15-,20+/m1/s1
InChIKey RWQBYZIVBZBWEC-QRWLVFNGSA-N
Instrument Name Shimadzu-GCMS 2010-DI-2010 spectrometer
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.p008.653
Molecular Weight 392.521 g/mol
Reported Formula C22H24N4OS
SMILES N1C=2N=C(N(C(C2CN([C@]1(c1ccccc1)[H])[C@@](c1ccccc1)(C)[H])=O)C)SC
SPLASH splash10-0a4r-1790000000-984be3eff274ec5b270e
Source of Spectrum ARK-2014-SM44-4g2
Wiley ID 1845616