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methyl 3-({[7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}amino)-4-methylbenzoate
SpectraBase Compound ID GAkgvbGy9T9
InChI InChI=1S/C23H18F2N4O3/c1-13-8-9-15(23(31)32-2)10-17(13)28-22(30)16-12-26-29-19(20(24)25)11-18(27-21(16)29)14-6-4-3-5-7-14/h3-12,20H,1-2H3,(H,28,30)
InChIKey VCTXPPKLYIGACC-UHFFFAOYSA-N
Mol Weight 436.42 g/mol
Molecular Formula C23H18F2N4O3
Exact Mass 436.134697 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7wly0MYRLFS
Name methyl 3-({[7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}amino)-4-methylbenzoate
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/C23H18F2N4O3/c1-13-8-9-15(23(31)32-2)10-17(13)28-22(30)16-12-26-29-19(20(24)25)11-18(27-21(16)29)14-6-4-3-5-7-14/h3-12,20H,1-2H3,(H,28,30)
InChIKey VCTXPPKLYIGACC-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_3371
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: 9315871; UBI_ID: UBI-003372
Temperature 313 °C