| SpectraBase Spectrum ID |
ElehNvEH2yw |
| Name |
4-Bromanyl-6-[2-(dipropylamino)ethyl]-1,3-dihydrobenzimidazole-2-thione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
355.071781894 u |
| Formula |
C15H22BrN3S |
| InChI |
InChI=1S/C15H22BrN3S/c1-3-6-19(7-4-2)8-5-11-9-12(16)14-13(10-11)17-15(20)18-14/h9-10H,3-8H2,1-2H3,(H2,17,18,20) |
| InChIKey |
JJHQHZKRRVRQBR-UHFFFAOYSA-N |
| Molecular Weight |
356.326 g/mol |
| SMILES |
C=12C(NC(N2)=S)=CC(=CC1Br)CCN(CCC)CCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.903611 |
![4-Bromanyl-6-[2-(dipropylamino)ethyl]-1,3-dihydrobenzimidazole-2-thione](/api/spectrum/ElehNvEH2yw/structure.png?h=300&w=458 "4-Bromanyl-6-[2-(dipropylamino)ethyl]-1,3-dihydrobenzimidazole-2-thione")
