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2-{[4-(2-adamantyl)-1-piperazinyl]carbonyl}-5,7-bis(difluoromethyl)pyrazolo[1,5-a]pyrimidine
SpectraBase Compound ID 4eHCIi0Y8mw
InChI InChI=1S/C23H27F4N5O/c24-21(25)16-10-18(22(26)27)32-19(28-16)11-17(29-32)23(33)31-3-1-30(2-4-31)20-14-6-12-5-13(8-14)9-15(20)7-12/h10-15,20-22H,1-9H2/t12-,13+,14-,15+,20?
InChIKey AQEPVODTSFZWAY-GZFUQFAMSA-N
Mol Weight 465.5 g/mol
Molecular Formula C23H27F4N5O
Exact Mass 465.215173 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3Rq2AEfwIRn
Name 2-{[4-(2-adamantyl)-1-piperazinyl]carbonyl}-5,7-bis(difluoromethyl)pyrazolo[1,5-a]pyrimidine
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/C23H27F4N5O/c24-21(25)16-10-18(22(26)27)32-19(28-16)11-17(29-32)23(33)31-3-1-30(2-4-31)20-14-6-12-5-13(8-14)9-15(20)7-12/h10-15,20-22H,1-9H2/t12-,13+,14-,15+,20?
InChIKey AQEPVODTSFZWAY-GZFUQFAMSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_10783
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/1026292; Labnumber: MEI0070; UZI_ID: UZI-010785
Temperature 308 °C