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3-(4-methoxyphenyl)-N-(4-methyl-3-nitrobenzoyl)-beta-alanine

View entire compound with spectra: 1 NMR

3-(4-methoxyphenyl)-N-(4-methyl-3-nitrobenzoyl)-beta-alanine
SpectraBase Compound ID 5sMXHqwtHiW
InChI InChI=1S/C18H18N2O6/c1-11-3-4-13(9-16(11)20(24)25)18(23)19-15(10-17(21)22)12-5-7-14(26-2)8-6-12/h3-9,15H,10H2,1-2H3,(H,19,23)(H,21,22)
InChIKey LUFNQFRCYVVWIL-UHFFFAOYSA-N
Mol Weight 358.35 g/mol
Molecular Formula C18H18N2O6
Exact Mass 358.116486 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BbxDj63cV0A
Name 3-(4-methoxyphenyl)-N-(4-methyl-3-nitrobenzoyl)-beta-alanine
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 358.116486302 u
Formula C18H18N2O6
InChI InChI=1S/C18H18N2O6/c1-11-3-4-13(9-16(11)20(24)25)18(23)19-15(10-17(21)22)12-5-7-14(26-2)8-6-12/h3-9,15H,10H2,1-2H3,(H,19,23)(H,21,22)
InChIKey LUFNQFRCYVVWIL-UHFFFAOYSA-N
Molecular Weight 358.350 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_2267
Solvent DMSO-d6
Source Vendor ID: NMR/12261086; Lab Info: SMM; Lab Number: SMM-MOS0390