SpectraBase Spectrum ID |
459P18U56BE |
Name |
4-((1S*,3S*)-3-hydroxy-2,2-dimethyl-6-methylenecyclohexyl)butan-2-one |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C13H22O2 |
InChI |
InChI=1S/C13H22O2/c1-9-5-8-12(15)13(3,4)11(9)7-6-10(2)14/h11-12,15H,1,5-8H2,2-4H3/t11-,12-/m0/s1 |
InChIKey |
HBWCPAQEOYPWMN-RYUDHWBXSA-N |
Literature Reference DOI |
10.1021/ol062798i |
Molecular Weight |
210.317 g/mol |
SMILES |
O[C@]1(CCC([C@@](C1(C)C)(CCC(C)=O)[H])=C)[H] |
SPLASH |
splash10-0006-9400000000-826e5ad4088d18dcb1f1 |
Source of Spectrum |
A1-9-583/SMS7-8b_exo |
Synonyms |
4-((1S,3S)-3-hydroxy-2,2-dimethyl-6-methylenecyclohexyl)butan-2-one |
Wiley ID |
1757817 |