| SpectraBase Spectrum ID |
D47TxkDhga2 |
| Name |
Cardamonin, diacetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
354.110338294 u |
| Formula |
C20H18O6 |
| InChI |
InChI=1S/C20H18O6/c1-13(21)25-16-11-18(24-3)20(19(12-16)26-14(2)22)17(23)10-9-15-7-5-4-6-8-15/h4-12H,1-3H3/b10-9+ |
| InChIKey |
DPAOTUFSDYKVPY-MDZDMXLPSA-N |
| Molecular Weight |
354.358 g/mol |
| SMILES |
C(\C=C\C1=CC=CC=C1)(=O)C1=C(OC)C=C(C=C1OC(C)=O)OC(C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.936614 |
