| SpectraBase Spectrum ID |
I4kXSTUDzxH |
| Name |
(3aS,5aR,6aR,6bS)-4-iodo-2,2-dimethyl-3a,5a,6a,6b-tetrahydrooxireno[2,3-g][1,3]benzodioxole |
| Appearance |
White, crystalline solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H11IO3 |
| InChI |
InChI=1S/C9H11IO3/c1-9(2)12-6-4(10)3-5-7(11-5)8(6)13-9/h3,5-8H,1-2H3/t5-,6-,7-,8-/m1/s1 |
| InChIKey |
CONVPYYRXUHYFD-WCTZXXKLSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.jnatprod.5b00304 |
| Molecular Weight |
294.088 g/mol |
| Optical Rotation |
[a]D =+146.4 (c = 0.7, CHCl3) |
| Reported Formula |
C9H11(127)IO3 |
| SMILES |
[C@@]12([C@]([C@]3([C@](OC(O3)(C)C)(C(I)=C1)[H])[H])(O2)[H])[H] |
| SPLASH |
splash10-0a6r-0690000000-2ed803b89aad52e87bc1 |
| Source of Spectrum |
G4-78-1966-7 |
| Wiley ID |
1867553 |
![(3aS,5aR,6aR,6bS)-4-iodo-2,2-dimethyl-3a,5a,6a,6b-tetrahydrooxireno[2,3-g][1,3]benzodioxole](/api/spectrum/I4kXSTUDzxH/structure.png?h=300&w=458 "(3aS,5aR,6aR,6bS)-4-iodo-2,2-dimethyl-3a,5a,6a,6b-tetrahydrooxireno[2,3-g][1,3]benzodioxole")
