| SpectraBase Compound ID | 1vJNFGB83Cs |
|---|---|
| InChI | InChI=1S/C10H14O2S/c1-13-8-9(11)7-12-10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3 |
| InChIKey | MAVLBOYMJSCOPW-UHFFFAOYSA-N |
| Mol Weight | 198.28 g/mol |
| Molecular Formula | C10H14O2S |
| Exact Mass | 198.071451 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HJWKM2JdNWZ |
|---|---|
| Name | 1-(Methylthio)-3-phenoxypropan-2-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 198.071450863 u |
| Formula | C10H14O2S |
| InChI | InChI=1S/C10H14O2S/c1-13-8-9(11)7-12-10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3 |
| InChIKey | MAVLBOYMJSCOPW-UHFFFAOYSA-N |
| Molecular Weight | 198.280 g/mol |
| SMILES | C(C(COC=1C=CC=CC1)O)SC |