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1-(1-adamantyl)-N-(4-bromo-2-fluorophenyl)-4-nitro-1H-pyrazole-3-carboxamide

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1-(1-adamantyl)-N-(4-bromo-2-fluorophenyl)-4-nitro-1H-pyrazole-3-carboxamide
SpectraBase Compound ID 2Bj9A7Ap0G8
InChI InChI=1S/C20H20BrFN4O3/c21-14-1-2-16(15(22)6-14)23-19(27)18-17(26(28)29)10-25(24-18)20-7-11-3-12(8-20)5-13(4-11)9-20/h1-2,6,10-13H,3-5,7-9H2,(H,23,27)
InChIKey GMVJOQMZYPBOEX-UHFFFAOYSA-N
Mol Weight 463.31 g/mol
Molecular Formula C20H20BrFN4O3
Exact Mass 462.070282 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CajFaW5YrS0
Name 1-(1-adamantyl)-N-(4-bromo-2-fluorophenyl)-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/C20H20BrFN4O3/c21-14-1-2-16(15(22)6-14)23-19(27)18-17(26(28)29)10-25(24-18)20-7-11-3-12(8-20)5-13(4-11)9-20/h1-2,6,10-13H,3-5,7-9H2,(H,23,27)
InChIKey GMVJOQMZYPBOEX-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_3075
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/9153135; Labnumber: BAC_UAMK/002458; UZI_ID: UZI-003077
Temperature 308 °C