| SpectraBase Spectrum ID |
JOkp3M6n2gd |
| Name |
(1S,6R,9R)-9-Acetoxy-2,4-dimethoxy-3-oxa-bicyclo[4.3.0]nonane |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
244.131073739 u |
| Formula |
C12H20O5 |
| InChI |
InChI=1S/C12H20O5/c1-7(13)16-9-5-4-8-6-10(14-2)17-12(15-3)11(8)9/h8-12H,4-6H2,1-3H3/t8-,9-,10?,11+,12?/m1/s1 |
| InChIKey |
YNDHTKRXMHJTDQ-GRGSRKJBSA-N |
| Molecular Weight |
244.287 g/mol |
| SMILES |
[C@]12(C(OC(C[C@]2(CC[C@]1(OC(=O)C)[H])[H])OC)OC)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.956563 |
![(1S,6R,9R)-9-Acetoxy-2,4-dimethoxy-3-oxa-bicyclo[4.3.0]nonane](/api/spectrum/JOkp3M6n2gd/structure.png?h=300&w=458 "(1S,6R,9R)-9-Acetoxy-2,4-dimethoxy-3-oxa-bicyclo[4.3.0]nonane")
