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N-{[5-(3-chloro-4-methoxyphenyl)-2-furyl]methyl}-2-[(1-phenyl-1H-tetraazol-5-yl)sulfanyl]ethanaminium chloride
SpectraBase Compound ID E58gnQ9tjWZ
InChI InChI=1S/C21H20ClN5O2S.ClH/c1-28-20-9-7-15(13-18(20)22)19-10-8-17(29-19)14-23-11-12-30-21-24-25-26-27(21)16-5-3-2-4-6-16;/h2-10,13,23H,11-12,14H2,1H3;1H
InChIKey LOOSXCLQGFWJFO-UHFFFAOYSA-N
Mol Weight 478.4 g/mol
Molecular Formula C21H21Cl2N5O2S
Exact Mass 477.079302 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CKHvaL1VUo7
Name N-{[5-(3-chloro-4-methoxyphenyl)-2-furyl]methyl}-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/C21H20ClN5O2S.ClH/c1-28-20-9-7-15(13-18(20)22)19-10-8-17(29-19)14-23-11-12-30-21-24-25-26-27(21)16-5-3-2-4-6-16;/h2-10,13,23H,11-12,14H2,1H3;1H
InChIKey LOOSXCLQGFWJFO-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_35358
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: E90927; SBI_ID: SBI-035362
Temperature 308 °C