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N-(1-adamantyl)-N'-[1-(4-fluorobenzyl)-1H-pyrazol-4-yl]urea
SpectraBase Compound ID HCwD3ARbSTd
InChI InChI=1S/C21H25FN4O/c22-18-3-1-14(2-4-18)12-26-13-19(11-23-26)24-20(27)25-21-8-15-5-16(9-21)7-17(6-15)10-21/h1-4,11,13,15-17H,5-10,12H2,(H2,24,25,27)/t15-,16+,17-,21-
InChIKey SJEVPFJOYJIHGT-YFHKMKNMSA-N
Mol Weight 368.46 g/mol
Molecular Formula C21H25FN4O
Exact Mass 368.20124 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CD7SNvPnIhi
Name N-(1-adamantyl)-N'-[1-(4-fluorobenzyl)-1H-pyrazol-4-yl]urea
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/C21H25FN4O/c22-18-3-1-14(2-4-18)12-26-13-19(11-23-26)24-20(27)25-21-8-15-5-16(9-21)7-17(6-15)10-21/h1-4,11,13,15-17H,5-10,12H2,(H2,24,25,27)/t15-,16+,17-,21-
InChIKey SJEVPFJOYJIHGT-YFHKMKNMSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_5798
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/9139821; Labnumber: B_U_ICN/000169; UZI_ID: UZI-005800
Temperature 318 °C