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4-{2-[(4-tert-butylphenyl)sulfanyl]ethyl}-1-methylpyridinium iodide
SpectraBase Compound ID Hv6SXfW5PSn
InChI InChI=1S/C18H24NS.HI/c1-18(2,3)16-5-7-17(8-6-16)20-14-11-15-9-12-19(4)13-10-15;/h5-10,12-13H,11,14H2,1-4H3;1H/q+1;/p-1
InChIKey HARDQWKAXNXGAK-UHFFFAOYSA-M
Mol Weight 413.36 g/mol
Molecular Formula C18H24INS
Exact Mass 413.067416 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GDpBE0BJ17
Name 4-{2-[(4-tert-butylphenyl)sulfanyl]ethyl}-1-methylpyridinium iodide
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/C18H24NS.HI/c1-18(2,3)16-5-7-17(8-6-16)20-14-11-15-9-12-19(4)13-10-15;/h5-10,12-13H,11,14H2,1-4H3;1H/q+1;/p-1
InChIKey HARDQWKAXNXGAK-UHFFFAOYSA-M
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_5387
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/8026342; Labnumber: BS-0000324; UZI_ID: UZI-005389
Temperature 313 °C