| SpectraBase Spectrum ID |
980ygjkdF2X |
| Name |
5-n-Butyl-3.beta.,9.beta.-dihydroxy-4,11-dioxatetracyclo[5.2.1.1(5,8).0(2,6)]undecane |
| Alternate Name(s) |
(4S,9S)-6-butyl-5,7-dioxatetracyclo[6.3.0.0(2,6).0(3,10)]undecane-4,9-diol |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H20O4 |
| InChI |
InChI=1S/C13H20O4/c1-2-3-4-13-9-7-5-6(8(9)12(15)17-13)10(14)11(7)16-13/h6-12,14-15H,2-5H2,1H3/t6-,7+,8+,9-,10-,11+,12-,13+/m0/s1 |
| InChIKey |
VTUNLWDQXLPEMT-YUEQNDEMSA-N |
| Molecular Weight |
240.299 g/mol |
| SMILES |
O[C@]1([C@@]2([C@@]3([C@]4([C@@](O[C@@]3(O)[H])(O[C@@]1([C@@]4(C2)[H])[H])CCCC)[H])[H])[H])[H] |
| SPLASH |
splash10-000i-9000000000-abf69ed84dd3565a49e4 |
| Source of Spectrum |
F-56-345-4 |
| Wiley ID |
855594 |
![5-n-Butyl-3.beta.,9.beta.-dihydroxy-4,11-dioxatetracyclo[5.2.1.1(5,8).0(2,6)]undecane](/api/spectrum/980ygjkdF2X/structure.png?h=300&w=458 "5-n-Butyl-3.beta.,9.beta.-dihydroxy-4,11-dioxatetracyclo[5.2.1.1(5,8).0(2,6)]undecane")
