| SpectraBase Spectrum ID |
GIZv98f7jQG |
| Name |
1H,4H-3a,8a-Ethanoazulen-4-one, hexahydro-9,10-dimethyl-, (3a.alpha.,8a.alpha.,9R*,10R*)- |
| Alternate Name(s) |
(1R,7R,11R,12R)-11,12-dimethyltricyclo[5.3.2.0(1,7)]dodecan-2-one
Dimethyl[5.3.2]propellanone (isomer a) |
| CAS Registry Number |
88288-18-0 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H22O |
| InChI |
InChI=1S/C14H22O/c1-10-11(2)14-9-5-8-13(10,14)7-4-3-6-12(14)15/h10-11H,3-9H2,1-2H3/t10-,11-,13-,14+/m1/s1 |
| InChIKey |
MVKLXCMJQLRYHL-OXHZDVMGSA-N |
| Molecular Weight |
206.329 g/mol |
| SMILES |
[C@@]123[C@@](CCC3)(CCCCC1=O)[C@@]([C@]2(C)[H])(C)[H] |
| SPLASH |
splash10-0udi-0900000000-6039d8b7f6a326f3ced4 |
| Source of Spectrum |
J-49-663-0 |
| Wiley ID |
1205111 |
