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1-(2-adamantyl)-4-{[1-(difluoromethyl)-1H-pyrazol-3-yl]carbonyl}piperazine
SpectraBase Compound ID AY3KMNS2BYp
InChI InChI=1S/C19H26F2N4O/c20-19(21)25-2-1-16(22-25)18(26)24-5-3-23(4-6-24)17-14-8-12-7-13(10-14)11-15(17)9-12/h1-2,12-15,17,19H,3-11H2/t12-,13+,14-,15+,17?
InChIKey BDJKHZMXJYLYIY-CQQIWXSWSA-N
Mol Weight 364.44 g/mol
Molecular Formula C19H26F2N4O
Exact Mass 364.207468 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7llkeNot4gp
Name 1-(2-adamantyl)-4-{[1-(difluoromethyl)-1H-pyrazol-3-yl]carbonyl}piperazine
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/C19H26F2N4O/c20-19(21)25-2-1-16(22-25)18(26)24-5-3-23(4-6-24)17-14-8-12-7-13(10-14)11-15(17)9-12/h1-2,12-15,17,19H,3-11H2/t12-,13+,14-,15+,17?
InChIKey BDJKHZMXJYLYIY-CQQIWXSWSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_29709
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: 1073449; SBI_ID: SBI-029713
Temperature 318 °C