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

*Links on SpectraBase are not permalinks.
2H-Pyrimido[1,2-a]pyrimidine, 1,3,4,6,7,8-hexahydro-4,6-bis(4-methylphenyl)-2,8-diphenyl-, monohydrochloride, (2.alpha.,4.alpha.,6.beta.,8.beta.)-(.+-.)-
SpectraBase Compound ID 5S65wRqvZFz
InChI InChI=1S/C33H33N3/c1-23-13-17-27(18-14-23)31-21-29(25-9-5-3-6-10-25)34-33-35-30(26-11-7-4-8-12-26)22-32(36(31)33)28-19-15-24(2)16-20-28/h3-20,29-32H,21-22H2,1-2H3,(H,34,35)/t29-,30-,31+,32+/m0/s1
InChIKey ILNRNERHLAXLEC-GASGPIRDSA-N
Mol Weight 471.6 g/mol
Molecular Formula C33H33N3
Exact Mass 471.267448 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 8KeNnve3BME
Name 2H-Pyrimido[1,2-a]pyrimidine, 1,3,4,6,7,8-hexahydro-4,6-bis(4-methylphenyl)-2,8-diphenyl-, monohydrochloride, (2.alpha.,4.alpha.,6.beta.,8.beta.)-(.+-.)-
CAS Registry Number 88129-03-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H33N3
InChI InChI=1S/C33H33N3/c1-23-13-17-27(18-14-23)31-21-29(25-9-5-3-6-10-25)34-33-35-30(26-11-7-4-8-12-26)22-32(36(31)33)28-19-15-24(2)16-20-28/h3-20,29-32H,21-22H2,1-2H3,(H,34,35)/t29-,30-,31+,32+/m0/s1
InChIKey ILNRNERHLAXLEC-GASGPIRDSA-N
Molecular Weight 471.648 g/mol
SMILES N1[C@@](C[C@@](N2C1=N[C@@](C[C@@]2(c1ccc(cc1)C)[H])(c1ccccc1)[H])(c1ccc(cc1)C)[H])(c1ccccc1)[H]
SPLASH splash10-00di-0631900000-0a303db58771cdec4b39
Source of Spectrum AH-114-731-0
Synonyms (2S,4R,6R,8S)-4,6-bis(4-methylphenyl)-2,8-diphenyl-1,3,4,6,7,8-hexahydro-2H-pyrimido[1,2-a]pyrimidine 2H-pyrimido[1,2-a]pyrimidine, 1,3,4,6,7,8-hexahydro-4,6-bis(4-methylphenyl)-2,8-diphenyl-, (2.alpha.,4.alpha.,6.beta.,8.beta.)-(.+-.)- 3,4,6,7,8,9-Hexahydro-2,8-diphenyl-4,6-bis(p-tolyl)-2H-pyrimido[1,2-a]pyrimidin-9a(1H)-ylium 3,4,6,7,8,9-Hexahydro-2,8-diphenyl-4,6-bis(p-tolyl)-2H-pyrimido[1,2-a]pyrimidin-9a(1H)-yliumchloride
Wiley ID 1393171