| SpectraBase Spectrum ID |
4gVt0Uzo3I9 |
| Name |
1,3-Dioxolane-4,5-dimethanol, 2,2-dimethyl-.alpha.,.alpha.'-dipentyl-, dibenzoate, [4R-[4.alpha.(S*),5.beta.(S*)]]- |
| Alternate Name(s) |
(1S)-1-{(4R,5S)-5-[1-(benzoyloxy)hexyl]-2,2-dimethyl-1,3-dioxolan-4-yl}hexyl benzoate
6(S),9(S)-dibenzoyloxy-7(R),8(R)-O-methylethylidene-7,8-tetradecanediol |
| CAS Registry Number |
125010-81-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C31H42O6 |
| InChI |
InChI=1S/C31H42O6/c1-5-7-11-21-25(34-29(32)23-17-13-9-14-18-23)27-28(37-31(3,4)36-27)26(22-12-8-6-2)35-30(33)24-19-15-10-16-20-24/h9-10,13-20,25-28H,5-8,11-12,21-22H2,1-4H3/t25-,26?,27+,28-/m0/s1 |
| InChIKey |
KNMYFXQRDDQDOB-RLFLVIJISA-N |
| Molecular Weight |
510.671 g/mol |
| SMILES |
[C@@]1([C@@](OC(O1)(C)C)(C(OC(=O)c1ccccc1)CCCCC)[H])([C@@](OC(=O)c1ccccc1)(CCCCC)[H])[H] |
| SPLASH |
splash10-0a59-1951000000-852883a94f49a1989b49 |
| Source of Spectrum |
F-45-2061-7 |
| Wiley ID |
1400574 |
![1,3-Dioxolane-4,5-dimethanol, 2,2-dimethyl-.alpha.,.alpha.'-dipentyl-, dibenzoate, [4R-[4.alpha.(S*),5.beta.(S*)]]-](/api/spectrum/4gVt0Uzo3I9/structure.png?h=300&w=458 "1,3-Dioxolane-4,5-dimethanol, 2,2-dimethyl-.alpha.,.alpha.'-dipentyl-, dibenzoate, [4R-[4.alpha.(S*),5.beta.(S*)]]-")
