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N-[4-(difluoromethoxy)-3-methoxyphenyl]-2-(4-oxo-1-phenyl-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide
SpectraBase Compound ID CdEBOS3QQ8X
InChI InChI=1S/C21H17F2N5O4/c1-31-17-9-13(7-8-16(17)32-21(22)23)26-18(29)11-27-12-24-19-15(20(27)30)10-25-28(19)14-5-3-2-4-6-14/h2-10,12,21H,11H2,1H3,(H,26,29)
InChIKey BABFELXJXLFQDJ-UHFFFAOYSA-N
Mol Weight 441.39 g/mol
Molecular Formula C21H17F2N5O4
Exact Mass 441.12486 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID G1JBVNCqOQM
Name N-[4-(difluoromethoxy)-3-methoxyphenyl]-2-(4-oxo-1-phenyl-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl)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/C21H17F2N5O4/c1-31-17-9-13(7-8-16(17)32-21(22)23)26-18(29)11-27-12-24-19-15(20(27)30)10-25-28(19)14-5-3-2-4-6-14/h2-10,12,21H,11H2,1H3,(H,26,29)
InChIKey BABFELXJXLFQDJ-UHFFFAOYSA-N
NMR Offset 15.3209
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_33885
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: 1998016; SBI_ID: SBI-033889
Temperature 297 °C