| SpectraBase Spectrum ID |
GuHWKjsHSBY |
| Name |
(3aS,4S,5R,7aS)-7-iodo-2,2-dimethyl-5-triisopropylsilyloxy-3a,4,5,7a-tetrahydro-1,3-benzodioxol-4-ol |
| Appearance |
White crystalline solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H33IO4Si |
| InChI |
InChI=1S/C18H33IO4Si/c1-10(2)24(11(3)4,12(5)6)23-14-9-13(19)16-17(15(14)20)22-18(7,8)21-16/h9-12,14-17,20H,1-8H3/t14-,15-,16-,17+/m1/s1 |
| InChIKey |
ZAFGTTIDPBYWPS-VQHPVUNQSA-N |
| Instrument Name |
Autospec Premier Micromass magnetic-sector |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np4002866 |
| Molecular Weight |
468.447 g/mol |
| Optical Rotation |
[a]D = -24 (c = 0.5, CHCl3) |
| Reported Formula |
C18H33IO4Si |
| SMILES |
O[C@]1([C@]2([C@](C(=C[C@]1(O[Si](C(C)C)(C(C)C)C(C)C)[H])I)([H])OC(C)(C)O2)[H])[H] |
| SPLASH |
splash10-00kf-0495000000-24db32d637878d5cd88d |
| Source of Spectrum |
G4-76-1517-Compound 6 |
| Thin-Layer Chromatography |
Rf = 0.3 (ethyl acetate/CH2Cl2/hexane, 0.5:2.5:5.5) |
| Wiley ID |
1865687 |
