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7-[chloranyl-bis(fluoranyl)methyl]-N-cyclooctyl-5-thiophen-2-yl-pyrazolo[1,5-a]pyrimidine-2-carboxamide
SpectraBase Compound ID BwiQUpfEYil
InChI InChI=1S/C20H21ClF2N4OS/c21-20(22,23)17-11-14(16-9-6-10-29-16)25-18-12-15(26-27(17)18)19(28)24-13-7-4-2-1-3-5-8-13/h6,9-13H,1-5,7-8H2,(H,24,28)
InChIKey ZPMOEOJUTVGKON-UHFFFAOYSA-N
Mol Weight 438.92 g/mol
Molecular Formula C20H21ClF2N4OS
Exact Mass 438.109267 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CxLJTabVgev
Name pyrazolo[1,5-a]pyrimidine-2-carboxamide, 7-(chlorodifluoromethyl)-N-cyclooctyl-5-(2-thienyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 438.109266511 u
Formula C20H21ClF2N4OS
InChI InChI=1S/C20H21ClF2N4OS/c21-20(22,23)17-11-14(16-9-6-10-29-16)25-18-12-15(26-27(17)18)19(28)24-13-7-4-2-1-3-5-8-13/h6,9-13H,1-5,7-8H2,(H,24,28)
InChIKey ZPMOEOJUTVGKON-UHFFFAOYSA-N
Molecular Weight 438.925 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_18094
Solvent DMSO-d6
Source Vendor ID: NMR/11250891; Lab Info: DAL; Lab Number: DAL-idk0361