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1H-isoindole-2-hexanoic acid, 2,3-dihydro-1,3-dioxo-, 4-(benzoylamino)tetrahydro-3-thienyl ester

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1H-isoindole-2-hexanoic acid, 2,3-dihydro-1,3-dioxo-, 4-(benzoylamino)tetrahydro-3-thienyl ester
SpectraBase Compound ID CAfS6HqnlSv
InChI InChI=1S/C25H26N2O5S/c28-22(32-21-16-33-15-20(21)26-23(29)17-9-3-1-4-10-17)13-5-2-8-14-27-24(30)18-11-6-7-12-19(18)25(27)31/h1,3-4,6-7,9-12,20-21H,2,5,8,13-16H2,(H,26,29)
InChIKey ARPLPAKFAAZELX-UHFFFAOYSA-N
Mol Weight 466.55 g/mol
Molecular Formula C25H26N2O5S
Exact Mass 466.156243 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9tyPK61GRIV
Name 1H-isoindole-2-hexanoic acid, 2,3-dihydro-1,3-dioxo-, 4-(benzoylamino)tetrahydro-3-thienyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 466.156243114 u
Formula C25H26N2O5S
InChI InChI=1S/C25H26N2O5S/c28-22(32-21-16-33-15-20(21)26-23(29)17-9-3-1-4-10-17)13-5-2-8-14-27-24(30)18-11-6-7-12-19(18)25(27)31/h1,3-4,6-7,9-12,20-21H,2,5,8,13-16H2,(H,26,29)
InChIKey ARPLPAKFAAZELX-UHFFFAOYSA-N
Molecular Weight 466.552 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17919
Solvent DMSO-d6
Source Vendor ID: NMR/11210281; Lab Info: RV; Lab Number: RV-0000003