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3-(3,4-dimethoxyphenyl)-N-(phenylsulfonyl)-beta-alanine

View entire compound with spectra: 1 NMR

3-(3,4-dimethoxyphenyl)-N-(phenylsulfonyl)-beta-alanine
SpectraBase Compound ID 2Btf3nFRyow
InChI InChI=1S/C17H19NO6S/c1-23-15-9-8-12(10-16(15)24-2)14(11-17(19)20)18-25(21,22)13-6-4-3-5-7-13/h3-10,14,18H,11H2,1-2H3,(H,19,20)
InChIKey OPIFPULRTVAYOK-UHFFFAOYSA-N
Mol Weight 365.4 g/mol
Molecular Formula C17H19NO6S
Exact Mass 365.093309 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2lVD8mklj0a
Name 3-(3,4-dimethoxyphenyl)-N-(phenylsulfonyl)-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 365.093308504 u
Formula C17H19NO6S
InChI InChI=1S/C17H19NO6S/c1-23-15-9-8-12(10-16(15)24-2)14(11-17(19)20)18-25(21,22)13-6-4-3-5-7-13/h3-10,14,18H,11H2,1-2H3,(H,19,20)
InChIKey OPIFPULRTVAYOK-UHFFFAOYSA-N
Molecular Weight 365.400 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_5783
Solvent DMSO-d6
Source Vendor ID: NMR/12267805; Lab Info: SP; Lab Number: SP-0000003