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7-(difluoromethyl)-N-[3-(4-ethoxyphenoxy)-5-nitrophenyl]-5-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SpectraBase Compound ID 6oSED7gXgvM
InChI InChI=1S/C28H21F2N5O5/c1-2-39-20-8-10-21(11-9-20)40-22-13-18(12-19(14-22)35(37)38)32-28(36)23-16-31-34-25(26(29)30)15-24(33-27(23)34)17-6-4-3-5-7-17/h3-16,26H,2H2,1H3,(H,32,36)
InChIKey VGXHODWSTFQECK-UHFFFAOYSA-N
Mol Weight 545.5 g/mol
Molecular Formula C28H21F2N5O5
Exact Mass 545.151075 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EbKiar9IIQ5
Name 7-(difluoromethyl)-N-[3-(4-ethoxyphenoxy)-5-nitrophenyl]-5-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide
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/C28H21F2N5O5/c1-2-39-20-8-10-21(11-9-20)40-22-13-18(12-19(14-22)35(37)38)32-28(36)23-16-31-34-25(26(29)30)15-24(33-27(23)34)17-6-4-3-5-7-17/h3-16,26H,2H2,1H3,(H,32,36)
InChIKey VGXHODWSTFQECK-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_3387
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: 9316053; UBI_ID: UBI-003388
Temperature 308 °C