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7-benzyl-1-(2-furylmethyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
SpectraBase Compound ID JXjIIsyNRbw
InChI InChI=1S/C20H14F6N4O3/c21-19(22,23)18(20(24,25)26)14-15(27-13(29-18)9-11-5-2-1-3-6-11)30(17(32)28-16(14)31)10-12-7-4-8-33-12/h1-8H,9-10H2,(H,27,29)(H,28,31,32)
InChIKey PFPHPSQWATWQCI-UHFFFAOYSA-N
Mol Weight 472.35 g/mol
Molecular Formula C20H14F6N4O3
Exact Mass 472.097009 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KEZWD7Zt8S2
Name 7-benzyl-1-(2-furylmethyl)-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/C20H14F6N4O3/c21-19(22,23)18(20(24,25)26)14-15(27-13(29-18)9-11-5-2-1-3-6-11)30(17(32)28-16(14)31)10-12-7-4-8-33-12/h1-8H,9-10H2,(H,27,29)(H,28,31,32)
InChIKey PFPHPSQWATWQCI-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_20235
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: D16431; Labnumber: SOK-1202; SBI_ID: SBI-020239
Temperature 315 °C