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6-{[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]sulfonyl}-3,4-dihydro-2(1H)-quinolinone
SpectraBase Compound ID BeZ0eanVlNj
InChI InChI=1S/C21H23N3O5S/c25-21-6-2-16-12-17(3-4-18(16)22-21)30(26,27)24-9-7-23(8-10-24)13-15-1-5-19-20(11-15)29-14-28-19/h1,3-5,11-12H,2,6-10,13-14H2,(H,22,25)
InChIKey IGNUHSBRDJFBQA-UHFFFAOYSA-N
Mol Weight 429.49 g/mol
Molecular Formula C21H23N3O5S
Exact Mass 429.135842 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1Z8Q8Zvpl9x
Name 6-{[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]sulfonyl}-3,4-dihydro-2(1H)-quinolinone
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 429.135842022 u
Formula C21H23N3O5S
InChI InChI=1S/C21H23N3O5S/c25-21-6-2-16-12-17(3-4-18(16)22-21)30(26,27)24-9-7-23(8-10-24)13-15-1-5-19-20(11-15)29-14-28-19/h1,3-5,11-12H,2,6-10,13-14H2,(H,22,25)
InChIKey IGNUHSBRDJFBQA-UHFFFAOYSA-N
Molecular Weight 429.491 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_2835
Solvent DMSO-d6
Source Vendor ID: NMR/12288078