| SpectraBase Spectrum ID |
4EwAYGY0Kyl |
| Name |
1,9-Diisopropyl-3beta,7.alpha.-dimethoxy-2,8,12-trioxatetracyclo[7.2.1.0.(4,11)0.(6,10)]dodecane |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
312.193673997 u |
| Formula |
C17H28O5 |
| InChI |
InChI=1S/C17H28O5/c1-8(2)16-12-10(14(18-5)20-16)7-11-13(12)17(22-16,9(3)4)21-15(11)19-6/h8-15H,7H2,1-6H3/t10?,11?,12?,13?,14-,15+,16?,17? |
| InChIKey |
NHMDVWHLJWSTEU-KLQAGBSFSA-N |
| Molecular Weight |
312.406 g/mol |
| SMILES |
C12(OC3(O[C@](OC)(C4C3C2C(C4)[C@@](O1)(OC)[H])[H])C(C)C)C(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.928031 |
![1,9-Diisopropyl-3beta,7.alpha.-dimethoxy-2,8,12-trioxatetracyclo[7.2.1.0.(4,11)0.(6,10)]dodecane](/api/spectrum/4EwAYGY0Kyl/structure.png?h=300&w=458 "1,9-Diisopropyl-3beta,7.alpha.-dimethoxy-2,8,12-trioxatetracyclo[7.2.1.0.(4,11)0.(6,10)]dodecane")
