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4-[4-bromo-1-(4-chlorobenzyl)-1H-pyrazol-3-yl]-4-azatricyclo[5.2.1.0~2,6~]dec-8-ene-3,5-dione
SpectraBase Compound ID JCsyQ8O7Ouq
InChI InChI=1S/C19H15BrClN3O2/c20-14-9-23(8-10-1-5-13(21)6-2-10)22-17(14)24-18(25)15-11-3-4-12(7-11)16(15)19(24)26/h1-6,9,11-12,15-16H,7-8H2
InChIKey YNNLIBKIVHOOEB-UHFFFAOYSA-N
Mol Weight 432.71 g/mol
Molecular Formula C19H15BrClN3O2
Exact Mass 431.003617 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID C9XVAKD2AnA
Name 4-[4-bromo-1-(4-chlorobenzyl)-1H-pyrazol-3-yl]-4-azatricyclo[5.2.1.0~2,6~]dec-8-ene-3,5-dione
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/C19H15BrClN3O2/c20-14-9-23(8-10-1-5-13(21)6-2-10)22-17(14)24-18(25)15-11-3-4-12(7-11)16(15)19(24)26/h1-6,9,11-12,15-16H,7-8H2
InChIKey YNNLIBKIVHOOEB-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_33839
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: 1996629; SBI_ID: SBI-033843
Temperature 315 °C