| SpectraBase Spectrum ID |
GkhLMKlIgRK |
| Name |
2,6,7-Trioxabicyclo[2.2.2]octane, 4-methyl-1-[[6-[tetrahydro-2,2-dimethyl-5-(2-propenylidene)-4H-cyclopenta[1,3]dioxol-4-yl]-1,3-benzodioxol-5-yl]methyl]-, (3a.alpha.,4.alpha.,5E,6a.alpha.)-(.+-.)- |
| Alternate Name(s) |
4H-Cyclopenta-1,3-dioxole, 2,6,7-trioxabicyclo[2.2.2]octane deriv.
(3a.alpha.,4.alpha.,5E,6a.alpha.)-(+-)-4-methyl-1-[[6-[tetrahydro-2,2-dimethyl-5-(2-propenylidene)-4H-cyclopenta-1,3-dioxol-4-yl]-1,3-benzodioxol-5-yl]-methyl]-2,6,7-trioxabicyclo[2.2.2]octane
1-({6-[(3aR,5E,6aS)-2,2-dimethyl-5-(2-propenylidene)tetrahydro-3aH-cyclopenta[d][1,3]dioxol-4-yl]-1,3-benzodioxol-5-yl}methyl)-4-methyl-2,6,7-trioxabicyclo[2.2.2]octane |
| CAS Registry Number |
113668-84-1 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H30O7 |
| InChI |
InChI=1S/C25H30O7/c1-5-6-15-7-20-22(32-23(2,3)31-20)21(15)17-9-19-18(26-14-27-19)8-16(17)10-25-28-11-24(4,12-29-25)13-30-25/h5-6,8-9,20-22H,1,7,10-14H2,2-4H3/b15-6+/t20-,21?,22-,24?,25?/m0/s1 |
| InChIKey |
RFIBSHDXECCLLQ-NXWSGOLZSA-N |
| Molecular Weight |
442.508 g/mol |
| SMILES |
c1(C2[C@@]3([C@](OC(O3)(C)C)([H])C\C2=C\C=C)[H])c(CC23OCC(CO3)(C)CO2)cc2c(c1)OCO2 |
| SPLASH |
splash10-000f-0004900000-0fcc8a2ede02e37ad8f8 |
| Source of Spectrum |
C-112-9607-25 |
| Wiley ID |
1385376 |
![2,6,7-Trioxabicyclo[2.2.2]octane, 4-methyl-1-[[6-[tetrahydro-2,2-dimethyl-5-(2-propenylidene)-4H-cyclopenta[1,3]dioxol-4-yl]-1,3-benzodioxol-5-yl]methyl]-, (3a.alpha.,4.alpha.,5E,6a.alpha.)-(.+-.)-](/api/spectrum/GkhLMKlIgRK/structure.png?h=300&w=458 "2,6,7-Trioxabicyclo[2.2.2]octane, 4-methyl-1-[[6-[tetrahydro-2,2-dimethyl-5-(2-propenylidene)-4H-cyclopenta[1,3]dioxol-4-yl]-1,3-benzodioxol-5-yl]methyl]-, (3a.alpha.,4.alpha.,5E,6a.alpha.)-(.+-.)-")
