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N-(1-bicyclo[2.2.1]hept-2-ylethyl)-4-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]benzamide
SpectraBase Compound ID JONBUUCg0co
InChI InChI=1S/C20H23BrN4O3/c1-12(17-9-14-4-7-16(17)8-14)22-20(26)15-5-2-13(3-6-15)10-24-11-18(21)19(23-24)25(27)28/h2-3,5-6,11-12,14,16-17H,4,7-10H2,1H3,(H,22,26)/t12?,14-,16+,17-/m0/s1
InChIKey YUUYQEFCXFQQEO-ANJKAXJUSA-N
Mol Weight 447.33 g/mol
Molecular Formula C20H23BrN4O3
Exact Mass 446.095354 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ap9MOC9OtVm
Name N-(1-bicyclo[2.2.1]hept-2-ylethyl)-4-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]benzamide
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/C20H23BrN4O3/c1-12(17-9-14-4-7-16(17)8-14)22-20(26)15-5-2-13(3-6-15)10-24-11-18(21)19(23-24)25(27)28/h2-3,5-6,11-12,14,16-17H,4,7-10H2,1H3,(H,22,26)/t12?,14-,16+,17-/m0/s1
InChIKey YUUYQEFCXFQQEO-ANJKAXJUSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_19139
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/9136201; UBI_ID: UBI-019142
Temperature 313 °C