| SpectraBase Spectrum ID |
B94ZHB7LwMf |
| Name |
(1S,6R)-1,5,5-Trimethyl-9-oxobicyclo[4.3.0]nonan-4-one ethylene acetal |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
238.156894565 u |
| Formula |
C14H22O3 |
| InChI |
InChI=1S/C14H22O3/c1-12(2)10-4-5-11(15)13(10,3)6-7-14(12)16-8-9-17-14/h10H,4-9H2,1-3H3/t10-,13+/m1/s1 |
| InChIKey |
WNGJYVRKPMUEQR-MFKMUULPSA-N |
| Molecular Weight |
238.327 g/mol |
| SMILES |
[C@@]12([C@@](C(C)(C)C3(CC2)OCCO3)(CCC1=O)[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.943034 |
![(1S,6R)-1,5,5-Trimethyl-9-oxobicyclo[4.3.0]nonan-4-one ethylene acetal](/api/spectrum/B94ZHB7LwMf/structure.png?h=300&w=458 "(1S,6R)-1,5,5-Trimethyl-9-oxobicyclo[4.3.0]nonan-4-one ethylene acetal")
