| SpectraBase Spectrum ID |
Eg00UDld2BM |
| Name |
1,7-Dimethyl-10-spiroethylene-2,4,6,13-tetraoxapentacyclo[5.5.1.0(3,11).0(5,9).0(8,12)]tridecane |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
236.104858991 u |
| Formula |
C13H16O4 |
| InChI |
InChI=1S/C13H16O4/c1-11-5-6-8-10(16-12(6,2)17-11)14-9(15-11)7(5)13(8)3-4-13/h5-10H,3-4H2,1-2H3/t5-,6+,7+,8-,9-,10+,11-,12+ |
| InChIKey |
YPVWQOAJHLHQHZ-KQJSWNCZSA-N |
| Molecular Weight |
236.267 g/mol |
| SMILES |
C12([C@@]3([C@]4([C@@]5(C)O[C@@]3(O[C@]3([C@@]1([C@@]4([C@](O5)(C)O3)[H])[H])[H])[H])[H])[H])CC2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.943239 |
![1,7-Dimethyl-10-spiroethylene-2,4,6,13-tetraoxapentacyclo[5.5.1.0(3,11).0(5,9).0(8,12)]tridecane](/api/spectrum/Eg00UDld2BM/structure.png?h=300&w=458 "1,7-Dimethyl-10-spiroethylene-2,4,6,13-tetraoxapentacyclo[5.5.1.0(3,11).0(5,9).0(8,12)]tridecane")
