| SpectraBase Spectrum ID |
57AVATNnW2F |
| Name |
1-Pentalenecarboxylic acid, octahydro-3a,6,6-trimethyl-, (1.alpha.,3a.alpha.,6a.alpha.)-(.+-.)- |
| CAS Registry Number |
85545-11-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H20O2 |
| InChI |
InChI=1S/C12H20O2/c1-10(2)7-8-11(3)5-4-6-12(10,11)9(13)14/h4-8H2,1-3H3,(H,13,14)/t11-,12-/m0/s1 |
| InChIKey |
MCEPXOUFSXVVJS-RYUDHWBXSA-N |
| Molecular Weight |
196.290 g/mol |
| SMILES |
OC([C@@]12[C@](CCC2(C)C)(CCC1)C)=O |
| SPLASH |
splash10-053s-9800000000-5917937d33a4de9243f6 |
| Source of Spectrum |
H-65-2419-0 |
| Synonyms |
(1R*,2R*,5S*)-5,8,8-trimethylbicyclo[3.3.0]octane-1-carboxylic acid
(3aS,6aS)-3,3,6a-trimethylhexahydro-3a(1H)-pentalenecarboxylic acid |
| Wiley ID |
1193465 |
