| SpectraBase Spectrum ID |
7cZqNHKWl38 |
| Name |
4H-1,2,4-triazole, 3-[[(2-bromophenyl)methyl]thio]-4-methyl-5-(4-nitrophenyl)- |
| Copyright |
Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
403.994259847 u |
| Formula |
C16H13BrN4O2S |
| InChI |
InChI=1S/C16H13BrN4O2S/c1-20-15(11-6-8-13(9-7-11)21(22)23)18-19-16(20)24-10-12-4-2-3-5-14(12)17/h2-9H,10H2,1H3 |
| InChIKey |
IDKORPCVVKPQDI-UHFFFAOYSA-N |
| Molecular Weight |
405.270 g/mol |
| NMR Offset |
16.1752 |
| NMR Spectrometer Frequency |
200.133 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_4089 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9253817; Lab Info: LP; Lab Number: LP-2190828 |
| Temperature |
39.85 °C |
![4H-1,2,4-triazole, 3-[[(2-bromophenyl)methyl]thio]-4-methyl-5-(4-nitrophenyl)-](/api/spectrum/7cZqNHKWl38/structure.png?h=300&w=458 "4H-1,2,4-triazole, 3-[[(2-bromophenyl)methyl]thio]-4-methyl-5-(4-nitrophenyl)-")
