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6-(1,3-Dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-[3-nitro-5-(phenylsulfanyl)phenyl]hexanamide
SpectraBase Compound ID 1BMNv6EUdIm
InChI InChI=1S/C26H23N3O5S/c30-24(13-5-2-8-14-28-25(31)22-11-6-7-12-23(22)26(28)32)27-18-15-19(29(33)34)17-21(16-18)35-20-9-3-1-4-10-20/h1,3-4,6-7,9-12,15-17H,2,5,8,13-14H2,(H,27,30)
InChIKey GTPOHOOXTQWJHK-UHFFFAOYSA-N
Mol Weight 489.55 g/mol
Molecular Formula C26H23N3O5S
Exact Mass 489.135842 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IgouxDdfc52
Name 1H-isoindole-2-hexanamide, 2,3-dihydro-N-[3-nitro-5-(phenylthio)phenyl]-1,3-dioxo-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 489.135842022 u
Formula C26H23N3O5S
InChI InChI=1S/C26H23N3O5S/c30-24(13-5-2-8-14-28-25(31)22-11-6-7-12-23(22)26(28)32)27-18-15-19(29(33)34)17-21(16-18)35-20-9-3-1-4-10-20/h1,3-4,6-7,9-12,15-17H,2,5,8,13-14H2,(H,27,30)
InChIKey GTPOHOOXTQWJHK-UHFFFAOYSA-N
Molecular Weight 489.546 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15035
Solvent DMSO-d6
Source Vendor ID: NMR/11210941; Lab Info: L-02; Lab Number: L-02/0102009