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1-(1H-indol-3-ylmethyl)-4-[(4-methylphenyl)sulfonyl]piperazin-1-ium
SpectraBase Compound ID JPFgvTMX0L4
InChI InChI=1S/C20H23N3O2S/c1-16-6-8-18(9-7-16)26(24,25)23-12-10-22(11-13-23)15-17-14-21-20-5-3-2-4-19(17)20/h2-9,14,21H,10-13,15H2,1H3/p+1
InChIKey OMDYQKZUZPUTCJ-UHFFFAOYSA-O
Mol Weight 370.49 g/mol
Molecular Formula C20H24N3O2S
Exact Mass 370.158923 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6m9RqSfMSVm
Name 1-(1H-indol-3-ylmethyl)-4-[(4-methylphenyl)sulfonyl]piperazin-1-ium
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C20H23N3O2S/c1-16-6-8-18(9-7-16)26(24,25)23-12-10-22(11-13-23)15-17-14-21-20-5-3-2-4-19(17)20/h2-9,14,21H,10-13,15H2,1H3/p+1
InChIKey OMDYQKZUZPUTCJ-UHFFFAOYSA-O
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_13916
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: UZI/9319113; UBI_ID: UBI-013919
Temperature 308 °C