| SpectraBase Spectrum ID |
KEWy2lPArxH |
| Name |
(1S,4'R)-1-(2',2'-Dimethyl-1',3'-dioxolan-4'-yl)heptadec-4-en-1-ol tosyl ester |
| Alternate Name(s) |
(1S,4E)-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-4-heptadecenyl 4-methylbenzenesulfonate
[(E,1S)-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]heptadec-4-enyl] 4-methylbenzenesulfonate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H48O5S |
| InChI |
InChI=1S/C29H48O5S/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-27(28-24-32-29(3,4)33-28)34-35(30,31)26-22-20-25(2)21-23-26/h16-17,20-23,27-28H,5-15,18-19,24H2,1-4H3/b17-16+/t27-,28+/m0/s1 |
| InChIKey |
FRGPEWREYXPSGZ-FLWDRURMSA-N |
| Molecular Weight |
508.758 g/mol |
| SMILES |
[C@](OS(c1ccc(cc1)C)(=O)=O)([C@@]1(OC(C)(C)OC1)[H])(CC\C=C\CCCCCCCCCCCC)[H] |
| SPLASH |
splash10-0udi-0009000000-9f759a46d50d12e9469d |
| Source of Spectrum |
KC-0-1185-12 |
| Wiley ID |
827861 |
