| SpectraBase Spectrum ID |
5HEGHqqPBSX |
| Name |
1,1'-{[(2-bromoethyl)sulfanyl]methanediyl}dibenzene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
306.007784657 u |
| Formula |
C15H15BrS |
| InChI |
InChI=1S/C15H15BrS/c16-11-12-17-15(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15H,11-12H2 |
| InChIKey |
MWBSHPKRMRSTJL-UHFFFAOYSA-N |
| Molecular Weight |
307.249 g/mol |
| SMILES |
C(Br)CSC(C1=CC=CC=C1)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.949776 |
![1,1'-{[(2-bromoethyl)sulfanyl]methanediyl}dibenzene](/api/spectrum/5HEGHqqPBSX/structure.png?h=300&w=458 "1,1'-{[(2-bromoethyl)sulfanyl]methanediyl}dibenzene")
