| SpectraBase Spectrum ID |
Au920w8vfST |
| Name |
(3R,6E)-1-(2-Fluoro-5-methoxyphenyl)-3,7,11-trimethyl-1-(phenylsulfanyl)dodeca-6,10-dien-3-ol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H37FO2S |
| InChI |
InChI=1S/C28H37FO2S/c1-21(2)11-9-12-22(3)13-10-18-28(4,30)20-27(32-24-14-7-6-8-15-24)25-19-23(31-5)16-17-26(25)29/h6-8,11,13-17,19,27,30H,9-10,12,18,20H2,1-5H3/b22-13+/t27?,28-/m1/s1 |
| InChIKey |
ZLQKTCYKDCECOO-FJRPRSMKSA-N |
| Literature Reference DOI |
10.1002/hlca.201200312 |
| Molecular Weight |
456.660 g/mol |
| SMILES |
O[C@@](CC(Sc1ccccc1)c1c(ccc(c1)OC)F)(CC\C=C\(CCC=C(C)C)C)C |
| SPLASH |
splash10-016t-5931100000-a5c52e07e755813328ae |
| Source of Spectrum |
H-95-1950-14b |
| Synonyms |
(3R,E)-1-(2-fluoro-5-methoxyphenyl)-3,7,11-trimethyl-1-(phenylthio)dodeca-6,10-dien-3-ol |
| Wiley ID |
1784186 |
