| SpectraBase Spectrum ID |
1dYup5VUfXx |
| Name |
Bicyclo[2.2.2]octane-2,3-dicarboxylic acid, 5-hydroxy-6-iodo-, 3-methyl ester, (1.alpha.,2.beta.,3.beta.,4.alpha.,5.beta.,6.alpha.)- |
| CAS Registry Number |
80060-61-3 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H15IO5 |
| InChI |
InChI=1S/C11H15IO5/c1-17-11(16)7-5-3-2-4(6(7)10(14)15)8(12)9(5)13/h4-9,13H,2-3H2,1H3,(H,14,15)/t4-,5+,6+,7-,8-,9-/m1/s1 |
| InChIKey |
VYVCOOYUJSMAAG-JZHWRPJLSA-N |
| Molecular Weight |
354.140 g/mol |
| SMILES |
O[C@]1([C@@]([C@@]2(CC[C@]1([C@]([C@]2(C(=O)O)[H])(C(=O)OC)[H])[H])[H])(I)[H])[H] |
| SPLASH |
splash10-004i-0932000000-816cddb21b5c05b6539f |
| Source of Spectrum |
B-34-1726-0 |
| Synonyms |
(1R,2R,3R,4S,5R,6R)-5-hydroxy-6-iodo-3-(methoxycarbonyl)bicyclo[2.2.2]octane-2-carboxylic acid
endo-5-hydroxy-exo-6-iodo-endo-3-methoxycarbonylbicyclo[2.2.2]octane-endo-2-carboxylic acid |
| Wiley ID |
1344201 |
![Bicyclo[2.2.2]octane-2,3-dicarboxylic acid, 5-hydroxy-6-iodo-, 3-methyl ester, (1.alpha.,2.beta.,3.beta.,4.alpha.,5.beta.,6.alpha.)-](/api/spectrum/1dYup5VUfXx/structure.png?h=300&w=458 "Bicyclo[2.2.2]octane-2,3-dicarboxylic acid, 5-hydroxy-6-iodo-, 3-methyl ester, (1.alpha.,2.beta.,3.beta.,4.alpha.,5.beta.,6.alpha.)-")
