SpectraBase Spectrum ID |
DTtDGUMgUMx |
Name |
Tricyclo[5.3.1.1(2,6)]dodeca-3,9-diene-11,12-diol, 4,5,9-trichloro-, 11-acetate, (1.alpha.,2.beta.,5.beta.,6.beta.,7.alpha.,11S*,12R*)- |
CAS Registry Number |
83098-81-1 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C14H15Cl3O3 |
InChI |
InChI=1S/C14H15Cl3O3/c1-5(18)20-14-8-2-6(15)3-9(14)11-12(17)10(16)4-7(8)13(11)19/h2,4,7-9,11-14,19H,3H2,1H3/t7-,8+,9-,11-,12-,13+,14+/m0/s1 |
InChIKey |
PCISVICGZIWJQI-DYVAAKBRSA-N |
Molecular Weight |
337.630 g/mol |
SMILES |
O[C@@]1([C@@]2([C@]3(C=C(C[C@@]([C@]1([C@](C(=C2)Cl)(Cl)[H])[H])([C@@]3(OC(=O)C)[H])[H])Cl)[H])[H])[H] |
SPLASH |
splash10-004m-9760000000-c451f475b5be65a9c551 |
Source of Spectrum |
H-65-1014-0 |
Synonyms |
(1S,2R,5R,6R,7S,11S,12R)-4,5,9-trichloro-12-hydroxytricyclo[5.3.1.1(2,6)]dodeca-3,9-dien-11-yl acetate
[11anti,12-3exo,4,9-trichloro-12endo-hydroxytricyclo[5.3.1.1(2,6)]dodeca-4,8-dien-11endo-yl]ester of acetic acid |
Wiley ID |
1332070 |