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N-[(5-methyl-2-thienyl)methyl]-3-[(1-phenyl-1H-tetraazol-5-yl)sulfanyl]-1-propanaminium chloride
SpectraBase Compound ID Dv4SJQdPn7f
InChI InChI=1S/C16H19N5S2.ClH/c1-13-8-9-15(23-13)12-17-10-5-11-22-16-18-19-20-21(16)14-6-3-2-4-7-14;/h2-4,6-9,17H,5,10-12H2,1H3;1H
InChIKey NJDAZGSHGBPFEE-UHFFFAOYSA-N
Mol Weight 381.94 g/mol
Molecular Formula C16H20ClN5S2
Exact Mass 381.084866 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Fdufj3T5y1I
Name N-[(5-methyl-2-thienyl)methyl]-3-[(1-phenyl-1H-tetraazol-5-yl)sulfanyl]-1-propanaminium chloride
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/C16H19N5S2.ClH/c1-13-8-9-15(23-13)12-17-10-5-11-22-16-18-19-20-21(16)14-6-3-2-4-7-14;/h2-4,6-9,17H,5,10-12H2,1H3;1H
InChIKey NJDAZGSHGBPFEE-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_35366
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: E90935; SBI_ID: SBI-035370
Temperature 308 °C