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

*Links on SpectraBase are not permalinks.
2(1H)-pyrimidinone, 4-[(E)-2-[4-(1-pyrrolidinyl)phenyl]ethenyl]-6-(trifluoromethyl)-
SpectraBase Compound ID 5fRn15ujg5I
InChI InChI=1S/C17H16F3N3O/c18-17(19,20)15-11-13(21-16(24)22-15)6-3-12-4-7-14(8-5-12)23-9-1-2-10-23/h3-8,11H,1-2,9-10H2,(H,21,22,24)/b6-3+
InChIKey QVILAMQEWHPVDX-ZZXKWVIFSA-N
Mol Weight 335.33 g/mol
Molecular Formula C17H16F3N3O
Exact Mass 335.124547 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 79iZFUYjfCq
Name 2(1H)-pyrimidinone, 4-[(E)-2-[4-(1-pyrrolidinyl)phenyl]ethenyl]-6-(trifluoromethyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 335.124546635 u
Formula C17H16F3N3O
InChI InChI=1S/C17H16F3N3O/c18-17(19,20)15-11-13(21-16(24)22-15)6-3-12-4-7-14(8-5-12)23-9-1-2-10-23/h3-8,11H,1-2,9-10H2,(H,21,22,24)/b6-3+
InChIKey QVILAMQEWHPVDX-ZZXKWVIFSA-N
Molecular Weight 335.330 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_5516
Solvent DMSO-d6
Source Vendor ID: NMR/9311288; Lab Info: SAD; Lab Number: SAD-das1051