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N-(4-fluorobenzyl)-3-[(1-phenyl-1H-tetraazol-5-yl)sulfanyl]-1-propanaminium chloride
SpectraBase Compound ID 3pZ5WPbTaeY
InChI InChI=1S/C17H18FN5S.ClH/c18-15-9-7-14(8-10-15)13-19-11-4-12-24-17-20-21-22-23(17)16-5-2-1-3-6-16;/h1-3,5-10,19H,4,11-13H2;1H
InChIKey XMZKQYZXDRLDTF-UHFFFAOYSA-N
Mol Weight 379.89 g/mol
Molecular Formula C17H19ClFN5S
Exact Mass 379.103373 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FwUcgyLdHxP
Name N-(4-fluorobenzyl)-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/C17H18FN5S.ClH/c18-15-9-7-14(8-10-15)13-19-11-4-12-24-17-20-21-22-23(17)16-5-2-1-3-6-16;/h1-3,5-10,19H,4,11-13H2;1H
InChIKey XMZKQYZXDRLDTF-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_35363
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: E90932; SBI_ID: SBI-035367
Temperature 308 °C