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

*Links on SpectraBase are not permalinks.
(5Z)-1-(3-chloro-4-methylphenyl)-5-{[1-(4-fluorobenzyl)-1H-indol-3-yl]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID G9spiUBYQSF
InChI InChI=1S/C27H19ClFN3O3/c1-16-6-11-20(13-23(16)28)32-26(34)22(25(33)30-27(32)35)12-18-15-31(24-5-3-2-4-21(18)24)14-17-7-9-19(29)10-8-17/h2-13,15H,14H2,1H3,(H,30,33,35)/b22-12-
InChIKey NHTWIAFSRPONTO-UUYOSTAYSA-N
Mol Weight 487.92 g/mol
Molecular Formula C27H19ClFN3O3
Exact Mass 487.109897 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 dXOEpXnk5x
Name (5Z)-1-(3-chloro-4-methylphenyl)-5-{[1-(4-fluorobenzyl)-1H-indol-3-yl]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C27H19ClFN3O3/c1-16-6-11-20(13-23(16)28)32-26(34)22(25(33)30-27(32)35)12-18-15-31(24-5-3-2-4-21(18)24)14-17-7-9-19(29)10-8-17/h2-13,15H,14H2,1H3,(H,30,33,35)/b22-12-
InChIKey NHTWIAFSRPONTO-UUYOSTAYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_19803
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D14602; Labnumber: CEP2K-25973; SBI_ID: SBI-019807
Synonyms 1-(3-chloro-4-methylphenyl)-5-{[1-(4-fluorobenzyl)-1H-indol-3-yl]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature 318 °C