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1,3-benzenedicarboxylic acid, 5-[[(4-bromo-1-ethyl-1H-pyrazol-5-yl)carbonyl]amino]-, dimethyl ester
SpectraBase Compound ID HPplxbE0Y4r
InChI InChI=1S/C16H16BrN3O5/c1-4-20-13(12(17)8-18-20)14(21)19-11-6-9(15(22)24-2)5-10(7-11)16(23)25-3/h5-8H,4H2,1-3H3,(H,19,21)
InChIKey GWXUNBYMTBNDKI-UHFFFAOYSA-N
Mol Weight 410.22 g/mol
Molecular Formula C16H16BrN3O5
Exact Mass 409.027334 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GvLkNdWkUNF
Name 1,3-benzenedicarboxylic acid, 5-[[(4-bromo-1-ethyl-1H-pyrazol-5-yl)carbonyl]amino]-, dimethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 409.027333622 u
Formula C16H16BrN3O5
InChI InChI=1S/C16H16BrN3O5/c1-4-20-13(12(17)8-18-20)14(21)19-11-6-9(15(22)24-2)5-10(7-11)16(23)25-3/h5-8H,4H2,1-3H3,(H,19,21)
InChIKey GWXUNBYMTBNDKI-UHFFFAOYSA-N
Molecular Weight 410.224 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_7256
Solvent DMSO-d6
Source Vendor ID: NMR/13301931; Lab Info: MAS; Lab Number: EtB-NAR0007