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2-(4-oxo-1-phenyl-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl)-N-[4-(trifluoromethoxy)phenyl]acetamide
SpectraBase Compound ID 8ud9Wy6kSHI
InChI InChI=1S/C20H14F3N5O3/c21-20(22,23)31-15-8-6-13(7-9-15)26-17(29)11-27-12-24-18-16(19(27)30)10-25-28(18)14-4-2-1-3-5-14/h1-10,12H,11H2,(H,26,29)
InChIKey AHHGZKPZEQEKJY-UHFFFAOYSA-N
Mol Weight 429.36 g/mol
Molecular Formula C20H14F3N5O3
Exact Mass 429.104874 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IUc5TX6S8wl
Name 2-(4-oxo-1-phenyl-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl)-N-[4-(trifluoromethoxy)phenyl]acetamide
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/C20H14F3N5O3/c21-20(22,23)31-15-8-6-13(7-9-15)26-17(29)11-27-12-24-18-16(19(27)30)10-25-28(18)14-4-2-1-3-5-14/h1-10,12H,11H2,(H,26,29)
InChIKey AHHGZKPZEQEKJY-UHFFFAOYSA-N
NMR Offset 17.9115
NMR Spectrometer Frequency 500.077
Observed nucleus 1H
Origin 1H_SBI_36227_33921
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: 1998075; SBI_ID: SBI-033925
Temperature 303 °C