| SpectraBase Spectrum ID |
BidyCMYV9n2 |
| Name |
1,2,3-Tris(butylthio)-1-propene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
306.150964488 u |
| Formula |
C15H30S3 |
| InChI |
InChI=1S/C15H30S3/c1-4-7-10-16-13-15(18-12-9-6-3)14-17-11-8-5-2/h13H,4-12,14H2,1-3H3/b15-13+ |
| InChIKey |
KMEAXOOVCBBEEG-FYWRMAATSA-N |
| Molecular Weight |
306.585 g/mol |
| SMILES |
C(S\C=C/(SCCCC)CSCCCC)CCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.960035 |
