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N~5~-(1-adamantylmethyl)-N~3~,N~3~-diethyl-1-methyl-1H-pyrazole-3,5-dicarboxamide

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N~5~-(1-adamantylmethyl)-N~3~,N~3~-diethyl-1-methyl-1H-pyrazole-3,5-dicarboxamide
SpectraBase Compound ID 67sQ8JYu0DA
InChI InChI=1S/C21H32N4O2/c1-4-25(5-2)20(27)17-9-18(24(3)23-17)19(26)22-13-21-10-14-6-15(11-21)8-16(7-14)12-21/h9,14-16H,4-8,10-13H2,1-3H3,(H,22,26)/t14-,15+,16-,21-
InChIKey JYILZPBJKYPHIZ-OFIQSVQDSA-N
Mol Weight 372.5 g/mol
Molecular Formula C21H32N4O2
Exact Mass 372.252526 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LEUFRnf07pd
Name N~5~-(1-adamantylmethyl)-N~3~,N~3~-diethyl-1-methyl-1H-pyrazole-3,5-dicarboxamide
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/C21H32N4O2/c1-4-25(5-2)20(27)17-9-18(24(3)23-17)19(26)22-13-21-10-14-6-15(11-21)8-16(7-14)12-21/h9,14-16H,4-8,10-13H2,1-3H3,(H,22,26)/t14-,15+,16-,21-
InChIKey JYILZPBJKYPHIZ-OFIQSVQDSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_33666
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: 1996308; SBI_ID: SBI-033670
Temperature 318 °C