For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
methyl 2-({[7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}amino)benzoate
SpectraBase Compound ID 5Gl0lPqtTUU
InChI InChI=1S/C22H16F2N4O3/c1-31-22(30)14-9-5-6-10-16(14)27-21(29)15-12-25-28-18(19(23)24)11-17(26-20(15)28)13-7-3-2-4-8-13/h2-12,19H,1H3,(H,27,29)
InChIKey RJNHKKKNXDABTP-UHFFFAOYSA-N
Mol Weight 422.39 g/mol
Molecular Formula C22H16F2N4O3
Exact Mass 422.119047 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID D77KswCvW3z
Name methyl 2-({[7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}amino)benzoate
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/C22H16F2N4O3/c1-31-22(30)14-9-5-6-10-16(14)27-21(29)15-12-25-28-18(19(23)24)11-17(26-20(15)28)13-7-3-2-4-8-13/h2-12,19H,1H3,(H,27,29)
InChIKey RJNHKKKNXDABTP-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_2353
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: 9312940; UBI_ID: UBI-002354
Temperature 318 °C