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1H-isoindole-2-acetamide, N-[4-[(diethylamino)sulfonyl]phenyl]-2,3-dihydro-alpha-[2-(methylthio)ethyl]-1-oxo-, (alpha~2~S)-

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1H-isoindole-2-acetamide, N-[4-[(diethylamino)sulfonyl]phenyl]-2,3-dihydro-alpha-[2-(methylthio)ethyl]-1-oxo-, (alpha~2~S)-
SpectraBase Compound ID E5wWGM9NnZP
InChI InChI=1S/C23H29N3O4S2/c1-4-25(5-2)32(29,30)19-12-10-18(11-13-19)24-22(27)21(14-15-31-3)26-16-17-8-6-7-9-20(17)23(26)28/h6-13,21H,4-5,14-16H2,1-3H3,(H,24,27)
InChIKey USBZRUITRZMMMD-UHFFFAOYSA-N
Mol Weight 475.62 g/mol
Molecular Formula C23H29N3O4S2
Exact Mass 475.159949 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID E7vmB6y5Sa9
Name 1H-isoindole-2-acetamide, N-[4-[(diethylamino)sulfonyl]phenyl]-2,3-dihydro-alpha-[2-(methylthio)ethyl]-1-oxo-, (alpha~2~S)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 475.159948770 u
Formula C23H29N3O4S2
InChI InChI=1S/C23H29N3O4S2/c1-4-25(5-2)32(29,30)19-12-10-18(11-13-19)24-22(27)21(14-15-31-3)26-16-17-8-6-7-9-20(17)23(26)28/h6-13,21H,4-5,14-16H2,1-3H3,(H,24,27)
InChIKey USBZRUITRZMMMD-UHFFFAOYSA-N
Molecular Weight 475.622 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_708
Solvent DMSO-d6
Source Vendor ID: NMR/12669872