| SpectraBase Spectrum ID |
EkWSe7DMzBn |
| Name |
(2S,3R,E)-1-(phenylthio)hepta-4,6-diene-2,3-diol |
| Alternate Name(s) |
(2S,3R,4E)-1-phenylsulfanylhepta-4,6-diene-2,3-diol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H16O2S |
| InChI |
InChI=1S/C13H16O2S/c1-2-3-9-12(14)13(15)10-16-11-7-5-4-6-8-11/h2-9,12-15H,1,10H2/b9-3+/t12-,13-/m1/s1 |
| InChIKey |
QUFMTSNPKIMESU-QVSIAFKYSA-N |
| Literature Reference DOI |
10.1021/ol900799e |
| Molecular Weight |
236.329 g/mol |
| SMILES |
O[C@@]([C@@](CSc1ccccc1)(O)[H])(\C=C\C=C)[H] |
| SPLASH |
splash10-0a4r-0900000000-da7d343a7dc28cf5740d |
| Source of Spectrum |
A1-11-2687/SMS5-11 |
| Wiley ID |
1756813 |
