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1-(3,4-Dimethyl-phenyl)-5-(2-fluoro-benzylsulfanyl)-1H-tetrazole

View entire compound with spectra: 2 NMR, and 1 MS (GC)

1-(3,4-Dimethyl-phenyl)-5-(2-fluoro-benzylsulfanyl)-1H-tetrazole
SpectraBase Compound ID C9NwJ8OSTaD
InChI InChI=1S/C16H15FN4S/c1-11-7-8-14(9-12(11)2)21-16(18-19-20-21)22-10-13-5-3-4-6-15(13)17/h3-9H,10H2,1-2H3
InChIKey ABTAJBGXZSOEKX-UHFFFAOYSA-N
Mol Weight 314.38 g/mol
Molecular Formula C16H15FN4S
Exact Mass 314.100146 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EmDFtOjRQwd
Name 1-(3,4-dimethylphenyl)-1H-tetraazol-5-yl 2-fluorobenzyl sulfide
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/C16H15FN4S/c1-11-7-8-14(9-12(11)2)21-16(18-19-20-21)22-10-13-5-3-4-6-15(13)17/h3-9H,10H2,1-2H3
InChIKey ABTAJBGXZSOEKX-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_2811
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: D04862; Labnumber: MVERET-0898; SBI_ID: SBI-002813
Synonyms 1-(3,4-dimethylphenyl)-5-[(2-fluorobenzyl)sulfanyl]-1H-tetraazole
Temperature 318 °C