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5-{[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]sulfonyl}-1-propionylindoline
SpectraBase Compound ID nnYAhQvvsd
InChI InChI=1S/C23H27N3O5S/c1-2-23(27)26-8-7-18-14-19(4-5-20(18)26)32(28,29)25-11-9-24(10-12-25)15-17-3-6-21-22(13-17)31-16-30-21/h3-6,13-14H,2,7-12,15-16H2,1H3
InChIKey UANRIZOXTZNZOK-UHFFFAOYSA-N
Mol Weight 457.55 g/mol
Molecular Formula C23H27N3O5S
Exact Mass 457.167142 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ChlADXLPkpu
Name 5-{[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]sulfonyl}-1-propionylindoline
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 457.167142150 u
Formula C23H27N3O5S
InChI InChI=1S/C23H27N3O5S/c1-2-23(27)26-8-7-18-14-19(4-5-20(18)26)32(28,29)25-11-9-24(10-12-25)15-17-3-6-21-22(13-17)31-16-30-21/h3-6,13-14H,2,7-12,15-16H2,1H3
InChIKey UANRIZOXTZNZOK-UHFFFAOYSA-N
Molecular Weight 457.545 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_4721
Solvent DMSO-d6
Source Vendor ID: NMR/12309800