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4-isoxazolecarboxylic acid, 5-amino-3-(4-methylphenyl)-, methylester

View entire compound with spectra: 1 NMR

4-isoxazolecarboxylic acid, 5-amino-3-(4-methylphenyl)-, methylester
SpectraBase Compound ID KtAO0hIrc3G
InChI InChI=1S/C12H12N2O3/c1-7-3-5-8(6-4-7)10-9(12(15)16-2)11(13)17-14-10/h3-6H,13H2,1-2H3
InChIKey JCJWEWGIKHOCPM-UHFFFAOYSA-N
Mol Weight 232.24 g/mol
Molecular Formula C12H12N2O3
Exact Mass 232.084792 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JHnNOw8xhl0
Name 4-isoxazolecarboxylic acid, 5-amino-3-(4-methylphenyl)-, methylester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 232.084792251 u
Formula C12H12N2O3
InChI InChI=1S/C12H12N2O3/c1-7-3-5-8(6-4-7)10-9(12(15)16-2)11(13)17-14-10/h3-6H,13H2,1-2H3
InChIKey JCJWEWGIKHOCPM-UHFFFAOYSA-N
Molecular Weight 232.239 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_97
Solvent DMSO-d6
Source Vendor ID: NMR/12669311