| SpectraBase Spectrum ID |
FVR1cN0Ggbi |
| Name |
(2R,3S,6E)-3,7,11-trimethyl-5-(phenylsulfonyl)dodeca-6,10-diene-2,3-diol |
| Alternate Name(s) |
(2R,3S,6E)-5-(benzenesulfonyl)-3,7,11-trimethyl-dodeca-6,10-diene-2,3-diol
(2R,3S,6E)-5-besyl-3,7,11-trimethyl-dodeca-6,10-diene-2,3-diol |
| CAS Registry Number |
128329-34-0 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H32O4S |
| InChI |
InChI=1S/C21H32O4S/c1-16(2)10-9-11-17(3)14-20(15-21(5,23)18(4)22)26(24,25)19-12-7-6-8-13-19/h6-8,10,12-14,18,20,22-23H,9,11,15H2,1-5H3/b17-14+/t18-,20?,21+/m1/s1 |
| InChIKey |
WRRDFKIEMLGFNO-GXSIVPSMSA-N |
| Molecular Weight |
380.543 g/mol |
| SMILES |
O[C@@]([C@](CC(S(=O)(=O)c1ccccc1)\C=C\(CCC=C(C)C)C)(O)C)(C)[H] |
| SPLASH |
splash10-014i-9002000000-71aaff7dfc64bd39535b |
| Source of Spectrum |
C-112-5286-31 |
| Wiley ID |
1359720 |
