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3-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-N-(2,3-dihydro-1H-inden-5-yl)benzamide
SpectraBase Compound ID L0JFVefR5qG
InChI InChI=1S/C20H17BrN4O3/c21-18-12-24(23-19(18)25(27)28)11-13-3-1-6-16(9-13)20(26)22-17-8-7-14-4-2-5-15(14)10-17/h1,3,6-10,12H,2,4-5,11H2,(H,22,26)
InChIKey BERRCEPVWHTROW-UHFFFAOYSA-N
Mol Weight 441.29 g/mol
Molecular Formula C20H17BrN4O3
Exact Mass 440.048403 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8TcElYB5VJk
Name 3-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-N-(2,3-dihydro-1H-inden-5-yl)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/C20H17BrN4O3/c21-18-12-24(23-19(18)25(27)28)11-13-3-1-6-16(9-13)20(26)22-17-8-7-14-4-2-5-15(14)10-17/h1,3,6-10,12H,2,4-5,11H2,(H,22,26)
InChIKey BERRCEPVWHTROW-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_3542
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/9150732; Labnumber: BAC_UAMK/012856; UZI_ID: UZI-003544
Temperature 318 °C