| SpectraBase Spectrum ID |
9oBb9a1Rljg |
| Name |
Endo-7-hydroxy-8,8-dimethyl-cis-bicyclo[4.3.0]nonan-2-one-ethyleneacetal |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
226.156894565 u |
| Formula |
C13H22O3 |
| InChI |
InChI=1S/C13H22O3/c1-12(2)8-10-9(11(12)14)4-3-5-13(10)15-6-7-16-13/h9-11,14H,3-8H2,1-2H3/t9-,10-,11?/m1/s1 |
| InChIKey |
CJVKTINBDZPFRM-DIOIDXFWSA-N |
| Molecular Weight |
226.316 g/mol |
| SMILES |
[C@@]12(C3(OCCO3)CCC[C@]1(C(O)C(C2)(C)C)[H])[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.823406 |
![Endo-7-hydroxy-8,8-dimethyl-cis-bicyclo[4.3.0]nonan-2-one-ethyleneacetal](/api/spectrum/9oBb9a1Rljg/structure.png?h=300&w=458 "Endo-7-hydroxy-8,8-dimethyl-cis-bicyclo[4.3.0]nonan-2-one-ethyleneacetal")
