| SpectraBase Compound ID | 2N5XWC9K7nX |
|---|---|
| InChI | InChI=1S/C10H12O2S/c11-10(12)6-7-13-8-9-4-2-1-3-5-9/h1-5H,6-8H2,(H,11,12) |
| InChIKey | NDBNSZKHDMXOJE-UHFFFAOYSA-N |
| Mol Weight | 196.26 g/mol |
| Molecular Formula | C10H12O2S |
| Exact Mass | 196.055801 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8SzCmjkVVJ2 |
|---|---|
| Name | 3-(benzylthio)propionic acid |
| Source of Sample | C. M. Buess, University of Georgia, Athens, Georgia |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H12O2S |
| InChI | InChI=1S/C10H12O2S/c11-10(12)6-7-13-8-9-4-2-1-3-5-9/h1-5H,6-8H2,(H,11,12) |
| InChIKey | NDBNSZKHDMXOJE-UHFFFAOYSA-N |
| Instrument Name | Varian A-60 |
| Literature Reference | JACS 77, 6613(1955) |
| Sadtler NMR Number | 6294M |
| Solvent | CDCl3 |