| SpectraBase Spectrum ID |
CaK7rQgaDvT |
| Name |
Methyl S-(-)-3-Formyl-2-(phenylthio)pentanoate |
| Alternate Name(s) |
Methyl (2S)-3-formyl-2-(phenylsulfanyl)pentanoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H16O3S |
| InChI |
InChI=1S/C13H16O3S/c1-3-10(9-14)12(13(15)16-2)17-11-7-5-4-6-8-11/h4-10,12H,3H2,1-2H3/t10?,12-/m0/s1 |
| InChIKey |
QCUSMHBHNKFBBX-KFJBMODSSA-N |
| Molecular Weight |
252.328 g/mol |
| SMILES |
[C@@](C(=O)OC)(Sc1ccccc1)(C(C=O)CC)[H] |
| SPLASH |
splash10-08mi-3920000000-72d561e311b51d0232fa |
| Source of Spectrum |
K-127-1717-12 |
| Wiley ID |
1255323 |
