| SpectraBase Spectrum ID |
1calPUAq9nn |
| Name |
(1S,2R,5R)-6,6-dimethyl-2-(2-oxobutyl)bicyclo[3.1.1]heptan-3-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H20O2 |
| InChI |
InChI=1S/C13H20O2/c1-4-9(14)7-10-11-5-8(6-12(10)15)13(11,2)3/h8,10-11H,4-7H2,1-3H3/t8-,10-,11+/m1/s1 |
| InChIKey |
IVQLMXVJWFENQU-IEBDPFPHSA-N |
| Molecular Weight |
208.301 g/mol |
| SMILES |
[C@]12(C(C)(C)[C@](C2)(CC([C@@]1(CC(=O)CC)[H])=O)[H])[H] |
| SPLASH |
splash10-0a70-9200000000-caf260831bc0884ff8e9 |
| Source of Spectrum |
H-83-627-3 |
| Synonyms |
6,6-Dimethyl-2-(2'-oxobutyl)bicyclo[3.1.1]heptan-3-one |
| Wiley ID |
846911 |
![(1S,2R,5R)-6,6-dimethyl-2-(2-oxobutyl)bicyclo[3.1.1]heptan-3-one](/api/spectrum/1calPUAq9nn/structure.png?h=300&w=458 "(1S,2R,5R)-6,6-dimethyl-2-(2-oxobutyl)bicyclo[3.1.1]heptan-3-one")
