| SpectraBase Spectrum ID |
4tVjCwbcFOA |
| Name |
3-Hexen-2-one, 4-methyl-5-(phenylthio)-, (E)- |
| Alternate Name(s) |
(3E)-4-methyl-5-(phenylsulfanyl)-3-hexen-2-one
4-Methyl-5-phenylthiohex-3-en-2-one |
| CAS Registry Number |
108378-33-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H16OS |
| InChI |
InChI=1S/C13H16OS/c1-10(9-11(2)14)12(3)15-13-7-5-4-6-8-13/h4-9,12H,1-3H3/b10-9+ |
| InChIKey |
LBLOVFSZWIWSST-MDZDMXLPSA-N |
| Molecular Weight |
220.330 g/mol |
| SMILES |
C(\C=C\(C(Sc1ccccc1)C)C)(=O)C |
| SPLASH |
splash10-03k9-3940000000-c21900ad04f670cf77b2 |
| Source of Spectrum |
KC-1986-1702-49 |
| Wiley ID |
1219841 |
