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

*Links on SpectraBase are not permalinks.
7-(3-chlorophenyl)-1-(2-phenylethyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
SpectraBase Compound ID 2kct9XtMNnT
InChI InChI=1S/C22H15ClF6N4O2/c23-14-8-4-7-13(11-14)16-30-17-15(20(32-16,21(24,25)26)22(27,28)29)18(34)31-19(35)33(17)10-9-12-5-2-1-3-6-12/h1-8,11H,9-10H2,(H,30,32)(H,31,34,35)
InChIKey XGKSDNOXWOJMDT-UHFFFAOYSA-N
Mol Weight 516.83 g/mol
Molecular Formula C22H15ClF6N4O2
Exact Mass 516.078772 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 1hxIVh3dgGB
Name 7-(3-chlorophenyl)-1-(2-phenylethyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
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/C22H15ClF6N4O2/c23-14-8-4-7-13(11-14)16-30-17-15(20(32-16,21(24,25)26)22(27,28)29)18(34)31-19(35)33(17)10-9-12-5-2-1-3-6-12/h1-8,11H,9-10H2,(H,30,32)(H,31,34,35)
InChIKey XGKSDNOXWOJMDT-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_25532
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: D49945; Labnumber: SOK-1730; SBI_ID: SBI-025536
Temperature 315 °C