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(6-chloro-4H-1,3-benzodioxin-8-yl)methyl 1-phenyl-1H-tetraazol-5-yl sulfide

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

(6-chloro-4H-1,3-benzodioxin-8-yl)methyl 1-phenyl-1H-tetraazol-5-yl sulfide
SpectraBase Compound ID 8gBEXTBSwEw
InChI InChI=1S/C16H13ClN4O2S/c17-13-6-11-8-22-10-23-15(11)12(7-13)9-24-16-18-19-20-21(16)14-4-2-1-3-5-14/h1-7H,8-10H2
InChIKey BYCJVRDVACUILT-UHFFFAOYSA-N
Mol Weight 360.82 g/mol
Molecular Formula C16H13ClN4O2S
Exact Mass 360.044775 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4uRflaMLUZK
Name 1H-tetrazole, 5-[[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]thio]-1-phenyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 360.044774547 u
Formula C16H13ClN4O2S
InChI InChI=1S/C16H13ClN4O2S/c17-13-6-11-8-22-10-23-15(11)12(7-13)9-24-16-18-19-20-21(16)14-4-2-1-3-5-14/h1-7H,8-10H2
InChIKey BYCJVRDVACUILT-UHFFFAOYSA-N
Molecular Weight 360.819 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17501
Solvent DMSO-d6
Source Vendor ID: NMR/10322556; Lab Info: LP; Lab Number: LP-2101850