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1-(1-adamantyl)-N-(4-fluorobenzyl)-4-nitro-1H-pyrazole-3-carboxamide

View entire compound with spectra: 1 NMR

1-(1-adamantyl)-N-(4-fluorobenzyl)-4-nitro-1H-pyrazole-3-carboxamide
SpectraBase Compound ID BqBTv7BOqp5
InChI InChI=1S/C21H23FN4O3/c22-17-3-1-13(2-4-17)11-23-20(27)19-18(26(28)29)12-25(24-19)21-8-14-5-15(9-21)7-16(6-14)10-21/h1-4,12,14-16H,5-11H2,(H,23,27)
InChIKey AFMMRUVXIGILNI-UHFFFAOYSA-N
Mol Weight 398.44 g/mol
Molecular Formula C21H23FN4O3
Exact Mass 398.175419 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4Ae5qADvtje
Name 1-(1-adamantyl)-N-(4-fluorobenzyl)-4-nitro-1H-pyrazole-3-carboxamide
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/C21H23FN4O3/c22-17-3-1-13(2-4-17)11-23-20(27)19-18(26(28)29)12-25(24-19)21-8-14-5-15(9-21)7-16(6-14)10-21/h1-4,12,14-16H,5-11H2,(H,23,27)
InChIKey AFMMRUVXIGILNI-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_3586
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/9150098; Labnumber: BAC_UAMK/013798; UZI_ID: UZI-003588
Temperature 308 °C