| SpectraBase Spectrum ID |
KsLy0bAYmQQ |
| Name |
N-(4-Bromo-3-chlorophenyl)-2-[(2,3,4,5,6-pentamethylbenzyl)thio]succinimide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
479.032140857 u |
| Formula |
C22H23BrClNO2S |
| InChI |
InChI=1S/C22H23BrClNO2S/c1-11-12(2)14(4)17(15(5)13(11)3)10-28-20-9-21(26)25(22(20)27)16-6-7-18(23)19(24)8-16/h6-8,20H,9-10H2,1-5H3 |
| InChIKey |
UCVJMXXVKZHFPY-UHFFFAOYSA-N |
| Molecular Weight |
480.848 g/mol |
| SMILES |
C1(=C(C(=C(C(=C1C)C)C)C)C)CSC1CC(N(C1=O)C=1C=C(C(=CC1)Br)Cl)=O |
| Spectrum/Structure Validation Score (Raman) |
0.883766 |
![N-(4-bromo-3-chlorophenyl)-2-[(2,3,4,5,6-pentamethylbenzyl)thio]succinimide](/api/spectrum/KsLy0bAYmQQ/structure.png?h=300&w=458 "N-(4-bromo-3-chlorophenyl)-2-[(2,3,4,5,6-pentamethylbenzyl)thio]succinimide")
