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Methanone, (4-bromo-3,5-dimethyl-1-pyrazolyl)(4-chloro-3-nitrophenyl)-
SpectraBase Compound ID HR3ZpymJH1I
InChI InChI=1S/C12H9BrClN3O3/c1-6-11(13)7(2)16(15-6)12(18)8-3-4-9(14)10(5-8)17(19)20/h3-5H,1-2H3
InChIKey KRAFTFBXSUBSTL-UHFFFAOYSA-N
Mol Weight 358.58 g/mol
Molecular Formula C12H9BrClN3O3
Exact Mass 356.951582 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9bOPcZ9Nw3A
Name 1H-pyrazole, 4-bromo-1-(4-chloro-3-nitrobenzoyl)-3,5-dimethyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 356.951581859 u
Formula C12H9BrClN3O3
InChI InChI=1S/C12H9BrClN3O3/c1-6-11(13)7(2)16(15-6)12(18)8-3-4-9(14)10(5-8)17(19)20/h3-5H,1-2H3
InChIKey KRAFTFBXSUBSTL-UHFFFAOYSA-N
Molecular Weight 358.579 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8840
Solvent DMSO-d6
Source Vendor ID: NMR/10230886; Lab Info: PNA; Lab Number: PNA-NA01043
Temperature 29.85 °C