| SpectraBase Compound ID | Is79KdtoqXm |
|---|---|
| InChI | InChI=1S/C8H15ClS/c1-7(5-9)6-10-8(2,3)4/h1,5-6H2,2-4H3 |
| InChIKey | SDRBPQDLSYWENP-UHFFFAOYSA-N |
| Mol Weight | 178.72 g/mol |
| Molecular Formula | C8H15ClS |
| Exact Mass | 178.058299 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 97u062qw2vY |
|---|---|
| Name | 2-(T-Butylthiomethyl)-3-chloro-1-propene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 178.058299357 u |
| Formula | C8H15ClS |
| InChI | InChI=1S/C8H15ClS/c1-7(5-9)6-10-8(2,3)4/h1,5-6H2,2-4H3 |
| InChIKey | SDRBPQDLSYWENP-UHFFFAOYSA-N |
| Molecular Weight | 178.721 g/mol |
| SMILES | C(=C)(CSC(C)(C)C)CCl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.93944 |