SpectraBase Spectrum ID |
JEq6SXfgeOp |
Name |
methyl 4-{5-[(2-bromobenzyl)sulfanyl]-1H-tetraazol-1-yl}benzoate |
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/C16H13BrN4O2S/c1-23-15(22)11-6-8-13(9-7-11)21-16(18-19-20-21)24-10-12-4-2-3-5-14(12)17/h2-9H,10H2,1H3 |
InChIKey |
KKZRBRWETMVSBU-UHFFFAOYSA-N |
NMR Offset |
15.5012 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_SBI_36227_22135 |
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: D58672; Labnumber: SPLUK-1037; SBI_ID: SBI-022139 |
Temperature |
315 °C |