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N-(2-chloro-6-fluorobenzyl)-2-[(1-phenyl-1H-tetraazol-5-yl)sulfanyl]ethanaminium chloride
SpectraBase Compound ID 6GBuIJI89PG
InChI InChI=1S/C16H15ClFN5S.ClH/c17-14-7-4-8-15(18)13(14)11-19-9-10-24-16-20-21-22-23(16)12-5-2-1-3-6-12;/h1-8,19H,9-11H2;1H
InChIKey DOOWNEKZHDLDQW-UHFFFAOYSA-N
Mol Weight 400.3 g/mol
Molecular Formula C16H16Cl2FN5S
Exact Mass 399.04875 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2YfoLJXSHsR
Name N-(2-chloro-6-fluorobenzyl)-2-[(1-phenyl-1H-tetraazol-5-yl)sulfanyl]ethanaminium 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/C16H15ClFN5S.ClH/c17-14-7-4-8-15(18)13(14)11-19-9-10-24-16-20-21-22-23(16)12-5-2-1-3-6-12;/h1-8,19H,9-11H2;1H
InChIKey DOOWNEKZHDLDQW-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_35343
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: E90912; SBI_ID: SBI-035347
Temperature 308 °C