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

*Links on SpectraBase are not permalinks.
2-[(E)-2-phenylethenyl]-3-[3-(trifluoromethyl)phenyl]-1,2-dihydroquinazolin-4-one
SpectraBase Compound ID L4czBq0MLaM
InChI InChI=1S/C23H17F3N2O/c24-23(25,26)17-9-6-10-18(15-17)28-21(14-13-16-7-2-1-3-8-16)27-20-12-5-4-11-19(20)22(28)29/h1-15,21,27H/b14-13+
InChIKey MRYWIDJHVPAQQB-BUHFOSPRSA-N
Mol Weight 394.4 g/mol
Molecular Formula C23H17F3N2O
Exact Mass 394.129298 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID FjPDGiuvv7l
Name 2-[(E)-2-Phenylethenyl]-3-[3-(trifluoromethyl)phenyl]-1,2-dihydroquinazolin-4-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 394.129297663 u
Formula C23H17F3N2O
InChI InChI=1S/C23H17F3N2O/c24-23(25,26)17-9-6-10-18(15-17)28-21(14-13-16-7-2-1-3-8-16)27-20-12-5-4-11-19(20)22(28)29/h1-15,21,27H/b14-13+
InChIKey MRYWIDJHVPAQQB-BUHFOSPRSA-N
Molecular Weight 394.397 g/mol
SMILES C1=CC=C(\C=C\C2N(C(C=3C=CC=CC3N2)=O)C=2C=C(C(F)(F)F)C=CC2)C=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.855333