1-isobutyl-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4,7(1H,3H,6H)-trione

SpectraBase Compound ID	IZmXi0STcKZ
InChI	InChI=1S/C12H12F6N4O3/c1-4(2)3-22-6-5(7(23)20-9(22)25)10(11(13,14)15,12(16,17)18)21-8(24)19-6/h4H,3H2,1-2H3,(H2,19,21,24)(H,20,23,25)
InChIKey	JSEHDOFELMGHLB-UHFFFAOYSA-N Google Search
Mol Weight	374.24 g/mol
Molecular Formula	C12H12F6N4O3
Exact Mass	374.081359 g/mol

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SpectraBase Spectrum ID	IpQwXz53Xu3
Name	1-isobutyl-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4,7(1H,3H,6H)-trione
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/C12H12F6N4O3/c1-4(2)3-22-6-5(7(23)20-9(22)25)10(11(13,14)15,12(16,17)18)21-8(24)19-6/h4H,3H2,1-2H3,(H2,19,21,24)(H,20,23,25)
InChIKey	JSEHDOFELMGHLB-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_27273
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: D75800; Labnumber: SOK-1218; SBI_ID: SBI-027277
Temperature	308 °C