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1H-pyrazole-4-carboxylic acid, 5-(bromomethyl)-1-phenyl-, ethylester
SpectraBase Compound ID BNqM8Ojn68p
InChI InChI=1S/C13H13BrN2O2/c1-2-18-13(17)11-9-15-16(12(11)8-14)10-6-4-3-5-7-10/h3-7,9H,2,8H2,1H3
InChIKey WTMIEMPELHKLJD-UHFFFAOYSA-N
Mol Weight 309.16 g/mol
Molecular Formula C13H13BrN2O2
Exact Mass 308.016041 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IOlemYlRoXk
Name 1H-pyrazole-4-carboxylic acid, 5-(bromomethyl)-1-phenyl-, ethylester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 308.016040665 u
Formula C13H13BrN2O2
InChI InChI=1S/C13H13BrN2O2/c1-2-18-13(17)11-9-15-16(12(11)8-14)10-6-4-3-5-7-10/h3-7,9H,2,8H2,1H3
InChIKey WTMIEMPELHKLJD-UHFFFAOYSA-N
Molecular Weight 309.163 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_7591
Solvent DMSO-d6
Source Vendor ID: NMR/12728329
Temperature 23.85 °C