| SpectraBase Spectrum ID |
LpetcxMMEok |
| Name |
(1S*,2S*,4S*,5S*,6S*,8R*)-4-Hydroxy-2,5,6-trimethyl-11-methylenetricyclo[6.2.1.0(1,6)]undecan-3-one |
| Appearance |
oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H22O2 |
| InChI |
InChI=1S/C15H22O2/c1-8-11-5-6-15(8)10(3)13(17)12(16)9(2)14(15,4)7-11/h9-12,16H,1,5-7H2,2-4H3/t9-,10-,11-,12+,14+,15-/m1/s1 |
| InChIKey |
QDTSSRCDTBHKAG-PWDJSDCWSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np020274v |
| Molecular Weight |
234.339 g/mol |
| Optical Rotation |
[a]D22 = -60.0 (c = 0.1, CHCl3) |
| Reported Formula |
C15H22O2 |
| SMILES |
O[C@@]1(C([C@]([C@@]23[C@]([C@@]1(C)[H])(C[C@](C3=C)(CC2)[H])C)(C)[H])=O)[H] |
| SPLASH |
splash10-067m-3900000000-52479ab5ce65b0a00ec7 |
| Source of Spectrum |
G4-66-437-1 |
| Synonyms |
4-Hydroxy-1,8-epi-isotenerone |
| Wiley ID |
1881250 |
![4-HYDROXY-1,8-EPI-ISOTENERONE;(1S*,2S*,4S*,5S*,6S*,8R*)-4-HYDROXY-2,5,6-TRIMETHYL-11-METHYLENETRICYCLO-[6.2.1.0(1,6)]-UNDECAN-3-ONE](/api/spectrum/LpetcxMMEok/structure.png?h=300&w=458 "4-HYDROXY-1,8-EPI-ISOTENERONE;(1S*,2S*,4S*,5S*,6S*,8R*)-4-HYDROXY-2,5,6-TRIMETHYL-11-METHYLENETRICYCLO-[6.2.1.0(1,6)]-UNDECAN-3-ONE")
