| SpectraBase Compound ID | 5Bhgy0fZWX3 |
|---|---|
| InChI | InChI=1S/C12H16O2S/c1-10(12(13)14-2)8-15-9-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3 |
| InChIKey | VIAAAKCYRCELPR-UHFFFAOYSA-N |
| Mol Weight | 224.32 g/mol |
| Molecular Formula | C12H16O2S |
| Exact Mass | 224.087101 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | I8EHA24eZvr |
|---|---|
| Name | 3-(BENZYLTHIO)-2-METHYLPROPIONIC ACID, METHYL ESTER |
| Source of Sample | Aldrich Chemical Company, Inc., Milwaukee, Wisconsin |
| Copyright | Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H16O2S |
| InChI | InChI=1S/C12H16O2S/c1-10(12(13)14-2)8-15-9-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3 |
| InChIKey | VIAAAKCYRCELPR-UHFFFAOYSA-N |
| Instrument Name | BRUKER AC-300 |
| Molecular Weight | 224.32 |
| Solvent | CDCl3; Reference=TMS; Temperature 297K |