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1H-isoindole-2-acetamide, N-(2,5-dimethoxyphenyl)-2,3-dihydro-alpha-[2-(methylthio)ethyl]-1-oxo-
SpectraBase Compound ID JUGEsaYIYcn
InChI InChI=1S/C21H24N2O4S/c1-26-15-8-9-19(27-2)17(12-15)22-20(24)18(10-11-28-3)23-13-14-6-4-5-7-16(14)21(23)25/h4-9,12,18H,10-11,13H2,1-3H3,(H,22,24)
InChIKey AAZYXFVOTZYWHV-UHFFFAOYSA-N
Mol Weight 400.49 g/mol
Molecular Formula C21H24N2O4S
Exact Mass 400.145678 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4NXb1NFcePC
Name 1H-isoindole-2-acetamide, N-(2,5-dimethoxyphenyl)-2,3-dihydro-alpha-[2-(methylthio)ethyl]-1-oxo-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 400.145678431 u
Formula C21H24N2O4S
InChI InChI=1S/C21H24N2O4S/c1-26-15-8-9-19(27-2)17(12-15)22-20(24)18(10-11-28-3)23-13-14-6-4-5-7-16(14)21(23)25/h4-9,12,18H,10-11,13H2,1-3H3,(H,22,24)
InChIKey AAZYXFVOTZYWHV-UHFFFAOYSA-N
Molecular Weight 400.493 g/mol
NMR Offset 18.0394
NMR Spectrometer Frequency 500.136
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_682
Solvent DMSO-d6
Source Vendor ID: NMR/12669749