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

*Links on SpectraBase are not permalinks.
3-(5,7-Diphenyl-4,7-dihydro-[1,2,3]triazolo[1,5-a]pyrimidin-6-yl)-1,3-diphenyl-propan-1-one
SpectraBase Compound ID hp4ZjMwuXQ
InChI InChI=1S/C32H26N4O/c37-28(24-15-7-2-8-16-24)21-27(23-13-5-1-6-14-23)30-31(25-17-9-3-10-18-25)34-29-22-33-35-36(29)32(30)26-19-11-4-12-20-26/h1-20,22,27,32,34H,21H2
InChIKey CQKGDLCIZWUWSC-UHFFFAOYSA-N
Mol Weight 482.6 g/mol
Molecular Formula C32H26N4O
Exact Mass 482.210661 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID HBMkbDkoFqZ
Name 3-(5,7-Diphenyl-4,7-dihydro-[1,2,3]triazolo[1,5-A]pyrimidin-6-yl)-1,3-diphenyl-propan-1-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 482.210661472 u
Formula C32H26N4O
InChI InChI=1S/C32H26N4O/c37-28(24-15-7-2-8-16-24)21-27(23-13-5-1-6-14-23)30-31(25-17-9-3-10-18-25)34-29-22-33-35-36(29)32(30)26-19-11-4-12-20-26/h1-20,22,27,32,34H,21H2
InChIKey CQKGDLCIZWUWSC-UHFFFAOYSA-N
Molecular Weight 482.587 g/mol
SMILES C=1C=CC(=CC1)C1=C(C(N2C(N1)=CN=N2)C1=CC=CC=C1)C(CC(C1=CC=CC=C1)=O)C1=CC=CC=C1