| SpectraBase Spectrum ID |
6bcEXPZaJz9 |
| Name |
(1S*,2S*,5R*,10R*)-1,6-Dimethyl-10-ethoxy-11-oxatricyclo[5.3.0.1(2,5)]undec-6-ene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
222.161979946 u |
| Formula |
C14H22O2 |
| InChI |
InChI=1S/C14H22O2/c1-4-15-12-7-5-10-9(2)11-6-8-13(16-11)14(10,12)3/h11-13H,4-8H2,1-3H3/t11-,12-,13+,14+/m1/s1 |
| InChIKey |
KKLHDFCVDJQWKD-MQYQWHSLSA-N |
| Molecular Weight |
222.328 g/mol |
| SMILES |
C=12[C@]([C@@]3(CC[C@@](O3)(C1C)[H])[H])([C@](OCC)(CC2)[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.975937 |
![(1S*,2S*,5R*,10R*)-1,6-dimethyl-10-ethoxy-11-oxatricyclo[5.3.0.1(2,5)]undec-6-ene](/api/spectrum/6bcEXPZaJz9/structure.png?h=300&w=458 "(1S*,2S*,5R*,10R*)-1,6-dimethyl-10-ethoxy-11-oxatricyclo[5.3.0.1(2,5)]undec-6-ene")
