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5-(4-methoxyphenyl)-1,3-dimethyl-6-[3-(trifluoromethyl)phenyl]-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
SpectraBase Compound ID 2bRp8mGCr1z
InChI InChI=1S/C22H18F3N3O3/c1-26-17-12-28(15-6-4-5-14(11-15)22(23,24)25)19(13-7-9-16(31-3)10-8-13)18(17)20(29)27(2)21(26)30/h4-12H,1-3H3
InChIKey ACTNSIAWFJHFMN-UHFFFAOYSA-N
Mol Weight 429.4 g/mol
Molecular Formula C22H18F3N3O3
Exact Mass 429.130026 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4yPQFYyO4v4
Name 5-(4-methoxyphenyl)-1,3-dimethyl-6-[3-(trifluoromethyl)phenyl]-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-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/C22H18F3N3O3/c1-26-17-12-28(15-6-4-5-14(11-15)22(23,24)25)19(13-7-9-16(31-3)10-8-13)18(17)20(29)27(2)21(26)30/h4-12H,1-3H3
InChIKey ACTNSIAWFJHFMN-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_27860
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: D79500; Labnumber: SC_0129-1017; SBI_ID: SBI-027864
Temperature 308 °C