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

*Links on SpectraBase are not permalinks.
2(1H)-Pyrimidinone, 1,1'-(2-methoxy-1,3-phenylene)bis[tetrahydro-3-(2-hydroxy-3,5-dimethy lphenyl)-
SpectraBase Compound ID El7OZfRwKEb
InChI InChI=1S/C31H36N4O5/c1-19-15-21(3)27(36)25(17-19)34-13-7-11-32(30(34)38)23-9-6-10-24(29(23)40-5)33-12-8-14-35(31(33)39)26-18-20(2)16-22(4)28(26)37/h6,9-10,15-18,36-37H,7-8,11-14H2,1-5H3
InChIKey FAZQRYSZOGNIPB-UHFFFAOYSA-N
Mol Weight 544.7 g/mol
Molecular Formula C31H36N4O5
Exact Mass 544.26857 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 GmrpVnvuFS4
Name 2(1H)-Pyrimidinone, 1,1'-(2-methoxy-1,3-phenylene)bis[tetrahydro-3-(2-hydroxy-3,5-dimethy lphenyl)-
CAS Registry Number 91084-90-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H36N4O5
InChI InChI=1S/C31H36N4O5/c1-19-15-21(3)27(36)25(17-19)34-13-7-11-32(30(34)38)23-9-6-10-24(29(23)40-5)33-12-8-14-35(31(33)39)26-18-20(2)16-22(4)28(26)37/h6,9-10,15-18,36-37H,7-8,11-14H2,1-5H3
InChIKey FAZQRYSZOGNIPB-UHFFFAOYSA-N
Molecular Weight 544.652 g/mol
SMILES Oc1c(N2C(N(c3c(c(N4C(N(c5c(c(cc(c5)C)C)O)CCC4)=O)ccc3)OC)CCC2)=O)cc(cc1C)C
SPLASH splash10-0006-0012090000-6facbf6a5d79c9324553
Source of Spectrum C-106-4985-0
Synonyms 1,1'-(2-Methoxy-1,3-phenylene)bis(tetrahydro-3-(2-hydroxy-3,5-dimethylphenyl)-2(1H)-pyrimidinone 1-(2-hydroxy-3,5-dimethylphenyl)-3-[3-(3-(2-hydroxy-3,5-dimethylphenyl)-2-oxotetrahydro-1(2H)-pyrimidinyl)-2-methoxyphenyl]tetrahydro-2(1H)-pyrimidinone
Wiley ID 1405067