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N-(2-adamantyl)-5-(4-fluorophenyl)-7-(1,1,2,2,2-pentafluoroethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
SpectraBase Compound ID LJUMI4Lvpzy
InChI InChI=1S/C25H22F6N4O/c26-17-3-1-14(2-4-17)18-10-20(24(27,28)25(29,30)31)35-21(32-18)11-19(34-35)23(36)33-22-15-6-12-5-13(8-15)9-16(22)7-12/h1-4,10-13,15-16,22H,5-9H2,(H,33,36)/t12-,13+,15-,16+,22?
InChIKey FCTJOPMFSTWMMP-FAIYTAPSSA-N
Mol Weight 508.47 g/mol
Molecular Formula C25H22F6N4O
Exact Mass 508.16978 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4Vfp3vljqEV
Name N-(2-adamantyl)-5-(4-fluorophenyl)-7-(1,1,2,2,2-pentafluoroethyl)pyrazolo[1,5-a]pyrimidine-2-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/C25H22F6N4O/c26-17-3-1-14(2-4-17)18-10-20(24(27,28)25(29,30)31)35-21(32-18)11-19(34-35)23(36)33-22-15-6-12-5-13(8-15)9-16(22)7-12/h1-4,10-13,15-16,22H,5-9H2,(H,33,36)/t12-,13+,15-,16+,22?
InChIKey FCTJOPMFSTWMMP-FAIYTAPSSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_686
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: UZI/1241662; Labnumber: AC-NHALL/0208233; UZI_ID: UZI-000688
Temperature 308 °C