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N-{[5-(3-chloro-4-methoxyphenyl)-2-furyl]methyl}-3-[(1-methyl-1H-tetraazol-5-yl)sulfanyl]-1-propanaminium chloride
SpectraBase Compound ID IHLqLT34Kei
InChI InChI=1S/C17H20ClN5O2S.ClH/c1-23-17(20-21-22-23)26-9-3-8-19-11-13-5-7-15(25-13)12-4-6-16(24-2)14(18)10-12;/h4-7,10,19H,3,8-9,11H2,1-2H3;1H
InChIKey ZPKWVRWAIGGMES-UHFFFAOYSA-N
Mol Weight 430.35 g/mol
Molecular Formula C17H21Cl2N5O2S
Exact Mass 429.079302 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID E2ny8DcCMkd
Name N-{[5-(3-chloro-4-methoxyphenyl)-2-furyl]methyl}-3-[(1-methyl-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/C17H20ClN5O2S.ClH/c1-23-17(20-21-22-23)26-9-3-8-19-11-13-5-7-15(25-13)12-4-6-16(24-2)14(18)10-12;/h4-7,10,19H,3,8-9,11H2,1-2H3;1H
InChIKey ZPKWVRWAIGGMES-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_35399
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: E90970; SBI_ID: SBI-035403
Temperature 308 °C