![4 -[(p-Methylthio)phenyl] allyl ether](/api/spectrum/AL9Fj0w3kjR/structure.png?h=300&w=458 "4 -[(p-Methylthio)phenyl] allyl ether")
| SpectraBase Compound ID | HcFjoov6OqB |
|---|---|
| InChI | InChI=1S/C10H12OS/c1-3-8-11-9-4-6-10(12-2)7-5-9/h3-7H,1,8H2,2H3 |
| InChIKey | ZWTAKOMULARGDG-UHFFFAOYSA-N |
| Mol Weight | 180.26 g/mol |
| Molecular Formula | C10H12OS |
| Exact Mass | 180.060886 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | AL9Fj0w3kjR |
|---|---|
| Name | 4 -[(p-Methylthio)phenyl] allyl ether |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 180.060886179 u |
| Formula | C10H12OS |
| InChI | InChI=1S/C10H12OS/c1-3-8-11-9-4-6-10(12-2)7-5-9/h3-7H,1,8H2,2H3 |
| InChIKey | ZWTAKOMULARGDG-UHFFFAOYSA-N |
| Molecular Weight | 180.265 g/mol |
| SMILES | C(=C)COC=1C=CC(=CC1)SC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.919288 |