| SpectraBase Spectrum ID |
EDwgssLQV80 |
| Name |
4-Acetoxy-8-hydroxy-6-(acetoxymethyl)-6,8-dimethyl-4,4A,5,6,7,7A,8,9-octahydro-3H-azuleno[5,6-C]furan-1-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
366.167853170 u |
| Formula |
C19H26O7 |
| InChI |
InChI=1S/C19H26O7/c1-10(20)25-9-18(3)5-13-15(7-18)19(4,23)6-12-14(8-24-17(12)22)16(13)26-11(2)21/h13,15-16,23H,5-9H2,1-4H3 |
| InChIKey |
BDRPCWSMODQJIF-UHFFFAOYSA-N |
| Molecular Weight |
366.410 g/mol |
| SMILES |
C1OC(C2=C1C(C1CC(CC1C(C2)(C)O)(C)COC(=O)C)OC(=O)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.956695 |
![4-Acetoxy-8-hydroxy-6-(acetoxymethyl)-6,8-dimethyl-4,4A,5,6,7,7A,8,9-octahydro-3H-azuleno[5,6-C]furan-1-one](/api/spectrum/EDwgssLQV80/structure.png?h=300&w=458 "4-Acetoxy-8-hydroxy-6-(acetoxymethyl)-6,8-dimethyl-4,4A,5,6,7,7A,8,9-octahydro-3H-azuleno[5,6-C]furan-1-one")
