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N-[1-(2-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-1-adamantanecarboxamide
SpectraBase Compound ID GaDqmS9ZNoU
InChI InChI=1S/C23H28ClN3O/c1-14-21(15(2)27(26-14)13-19-5-3-4-6-20(19)24)25-22(28)23-10-16-7-17(11-23)9-18(8-16)12-23/h3-6,16-18H,7-13H2,1-2H3,(H,25,28)/t16-,17+,18-,23-
InChIKey MWCZEDVLDAAFSQ-BRGRSMLUSA-N
Mol Weight 397.95 g/mol
Molecular Formula C23H28ClN3O
Exact Mass 397.19209 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7ksaV767hV2
Name N-[1-(2-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-1-adamantanecarboxamide
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/C23H28ClN3O/c1-14-21(15(2)27(26-14)13-19-5-3-4-6-20(19)24)25-22(28)23-10-16-7-17(11-23)9-18(8-16)12-23/h3-6,16-18H,7-13H2,1-2H3,(H,25,28)/t16-,17+,18-,23-
InChIKey MWCZEDVLDAAFSQ-BRGRSMLUSA-N
NMR Offset 16.0772
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_1745
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: 9266344; UBI_ID: UBI-001746
Temperature 308 °C