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N-{3-[4-(acetylamino)phenoxy]-5-nitrophenyl}-7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SpectraBase Compound ID 1zuJLc0HBLC
InChI InChI=1S/C28H20F2N6O5/c1-16(37)32-18-7-9-21(10-8-18)41-22-12-19(11-20(13-22)36(39)40)33-28(38)23-15-31-35-25(26(29)30)14-24(34-27(23)35)17-5-3-2-4-6-17/h2-15,26H,1H3,(H,32,37)(H,33,38)
InChIKey OCMHRQPYKKTDAG-UHFFFAOYSA-N
Mol Weight 558.5 g/mol
Molecular Formula C28H20F2N6O5
Exact Mass 558.146324 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1fsEc0VHPFT
Name N-{3-[4-(acetylamino)phenoxy]-5-nitrophenyl}-7-(difluoromethyl)-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/C28H20F2N6O5/c1-16(37)32-18-7-9-21(10-8-18)41-22-12-19(11-20(13-22)36(39)40)33-28(38)23-15-31-35-25(26(29)30)14-24(34-27(23)35)17-5-3-2-4-6-17/h2-15,26H,1H3,(H,32,37)(H,33,38)
InChIKey OCMHRQPYKKTDAG-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_3065
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: 9314173; UBI_ID: UBI-003066
Temperature 313 °C