| SpectraBase Spectrum ID |
JCXIGnHxpy8 |
| Name |
(3R,4S,6R)-2-((6,10-dimethyl-8-oxo-2-(prop-1-en-2-yl)spiro[4.5]dec-9-en-7-yl)oxy)-6-((2,2,2-trifluoroacetoxy)methyl)tetrahydro-2H-pyran-3,4,5-triyl tris(2,2,2-trifluoroacetate) |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H28F12O11 |
| InChI |
InChI=1S/C29H28F12O11/c1-10(2)13-5-6-25(8-13)11(3)7-14(42)16(12(25)4)49-20-19(52-24(46)29(39,40)41)18(51-23(45)28(36,37)38)17(50-22(44)27(33,34)35)15(48-20)9-47-21(43)26(30,31)32/h7,12-13,15-20H,1,5-6,8-9H2,2-4H3 |
| InChIKey |
QCTRMGLTTKTGCD-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1016/j.chroma.2013.08.051 |
| Molecular Weight |
780.513 g/mol |
| SMILES |
C1(C(C(C(C(O1)OC1C(C2(C(=CC1=O)C)CC(CC2)C(=C)C)C)OC(C(F)(F)F)=O)OC(C(F)(F)F)=O)OC(C(F)(F)F)=O)COC(C(F)(F)F)=O |
| SPLASH |
splash10-0690-3920000000-dd653762806dec5a5e82 |
| Source of Spectrum |
Kai Cai, et al. Journal of Chromatography A, 10.1016/j.chroma.2013.08.051 |
| Wiley ID |
1816196 |
![(3R,4S,6R)-2-((6,10-dimethyl-8-oxo-2-(prop-1-en-2-yl)spiro[4.5]dec-9-en-7-yl)oxy)-6-((2,2,2-trifluoroacetoxy)methyl)tetrahydro-2H-pyran-3,4,5-triyl tris(2,2,2-trifluoroacetate)](/api/spectrum/JCXIGnHxpy8/structure.png?h=300&w=458 "(3R,4S,6R)-2-((6,10-dimethyl-8-oxo-2-(prop-1-en-2-yl)spiro[4.5]dec-9-en-7-yl)oxy)-6-((2,2,2-trifluoroacetoxy)methyl)tetrahydro-2H-pyran-3,4,5-triyl tris(2,2,2-trifluoroacetate)")
