| SpectraBase Spectrum ID |
KOgjX5BpAfK |
| Name |
rel-(1R,2S,5S,8S,9R)-2,5,9-trimethyl-11-oxotricyclo[6.3.0.0(1,5)]undec-3-ene-3-carboxylic acid |
| Alternate Name(s) |
(1S,3aS,5aS,6R,8aR)-1,3a,6-trimethyl-8-oxo-1,3a,4,5,5a,6,7,8-octahydrocyclopenta[c]pentalene-2-carboxylic acid |
| CAS Registry Number |
113429-19-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H20O3 |
| InChI |
InChI=1S/C15H20O3/c1-8-6-12(16)15-9(2)10(13(17)18)7-14(15,3)5-4-11(8)15/h7-9,11H,4-6H2,1-3H3,(H,17,18)/t8-,9-,11+,14+,15-/m1/s1 |
| InChIKey |
LFKSRWRSZVCLFJ-HHYGZGRMSA-N |
| Molecular Weight |
248.322 g/mol |
| SMILES |
OC(C=1[C@]([C@]23[C@](C1)(CC[C@]3([C@](C)(CC2=O)[H])[H])C)(C)[H])=O |
| SPLASH |
splash10-001i-0190000000-079affc950b6db3d1fa2 |
| Source of Spectrum |
J-53-1628-4 |
| Wiley ID |
1251373 |
![rel-(1R,2S,5S,8S,9R)-2,5,9-trimethyl-11-oxotricyclo[6.3.0.0(1,5)]undec-3-ene-3-carboxylic acid](/api/spectrum/KOgjX5BpAfK/structure.png?h=300&w=458 "rel-(1R,2S,5S,8S,9R)-2,5,9-trimethyl-11-oxotricyclo[6.3.0.0(1,5)]undec-3-ene-3-carboxylic acid")
