7-(3-chlorophenyl)-1-(4-fluorophenyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione

SpectraBase Compound ID	LNifplHrFY
InChI	InChI=1S/C20H10ClF7N4O2/c21-10-3-1-2-9(8-10)14-29-15-13(18(31-14,19(23,24)25)20(26,27)28)16(33)30-17(34)32(15)12-6-4-11(22)5-7-12/h1-8H,(H,29,31)(H,30,33,34)
InChIKey	XMJHCYUFLUFOBC-UHFFFAOYSA-N Google Search
Mol Weight	506.77 g/mol
Molecular Formula	C20H10ClF7N4O2
Exact Mass	506.03805 g/mol

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SpectraBase Spectrum ID	Hh0fRJHvNg0
Name	7-(3-chlorophenyl)-1-(4-fluorophenyl)-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/C20H10ClF7N4O2/c21-10-3-1-2-9(8-10)14-29-15-13(18(31-14,19(23,24)25)20(26,27)28)16(33)30-17(34)32(15)12-6-4-11(22)5-7-12/h1-8H,(H,29,31)(H,30,33,34)
InChIKey	XMJHCYUFLUFOBC-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_25530
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: D49943; Labnumber: SOK-1728; SBI_ID: SBI-025534
Temperature	315 °C