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5-[(5-chloro-2-nitrophenyl)sulfanyl]-1-phenyl-1H-tetraazole
SpectraBase Compound ID FsauDAoHN3S
InChI InChI=1S/C13H8ClN5O2S/c14-9-6-7-11(19(20)21)12(8-9)22-13-15-16-17-18(13)10-4-2-1-3-5-10/h1-8H
InChIKey VMGJQYVOKYNSBV-UHFFFAOYSA-N
Mol Weight 333.75 g/mol
Molecular Formula C13H8ClN5O2S
Exact Mass 333.008723 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KZAvBfK9lDu
Name 5-[(5-chloro-2-nitrophenyl)sulfanyl]-1-phenyl-1H-tetraazole
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/C13H8ClN5O2S/c14-9-6-7-11(19(20)21)12(8-9)22-13-15-16-17-18(13)10-4-2-1-3-5-10/h1-8H
InChIKey VMGJQYVOKYNSBV-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_5887
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: NMR/11241349; Labnumber: LP-2501798; IOH_ID: IOH-005888
Synonyms 5-chloro-2-nitrophenyl 1-phenyl-1H-tetraazol-5-yl sulfide