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7-(3-chlorophenyl)-1-phenyl-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
SpectraBase Compound ID 2NihPmCmomE
InChI InChI=1S/C20H11ClF6N4O2/c21-11-6-4-5-10(9-11)14-28-15-13(18(30-14,19(22,23)24)20(25,26)27)16(32)29-17(33)31(15)12-7-2-1-3-8-12/h1-9H,(H,28,30)(H,29,32,33)
InChIKey ZAQSPVKACAPMMJ-UHFFFAOYSA-N
Mol Weight 488.78 g/mol
Molecular Formula C20H11ClF6N4O2
Exact Mass 488.047472 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ed056Sq6VKF
Name 7-(3-chlorophenyl)-1-phenyl-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/C20H11ClF6N4O2/c21-11-6-4-5-10(9-11)14-28-15-13(18(30-14,19(22,23)24)20(25,26)27)16(32)29-17(33)31(15)12-7-2-1-3-8-12/h1-9H,(H,28,30)(H,29,32,33)
InChIKey ZAQSPVKACAPMMJ-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_25529
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: D49942; Labnumber: SOK-1727; SBI_ID: SBI-025533
Temperature 315 °C