![2-[(Benzylthio)methyl]-1,3-dioxolane](/api/spectrum/1fvvqO4rUud/structure.png?h=300&w=458 "2-[(Benzylthio)methyl]-1,3-dioxolane")
| SpectraBase Compound ID | FoMb3y7NO2i |
|---|---|
| InChI | InChI=1S/C11H14O2S/c1-2-4-10(5-3-1)8-14-9-11-12-6-7-13-11/h1-5,11H,6-9H2 |
| InChIKey | DFHWMYZCCCKCPC-UHFFFAOYSA-N |
| Mol Weight | 210.29 g/mol |
| Molecular Formula | C11H14O2S |
| Exact Mass | 210.071451 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 | 1fvvqO4rUud |
|---|---|
| Name | 2-[(Benzylthio)methyl]-1,3-dioxolane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 210.071450863 u |
| Formula | C11H14O2S |
| InChI | InChI=1S/C11H14O2S/c1-2-4-10(5-3-1)8-14-9-11-12-6-7-13-11/h1-5,11H,6-9H2 |
| InChIKey | DFHWMYZCCCKCPC-UHFFFAOYSA-N |
| Molecular Weight | 210.291 g/mol |
| SMILES | C1(OCCO1)CSCC=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.947865 |