| SpectraBase Spectrum ID |
HxW9GjjSR7M |
| Name |
Cordyol C, 3ac derivative |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
372.120902977 u |
| Formula |
C20H20O7 |
| InChI |
InChI=1S/C20H20O7/c1-11-6-16(24-13(3)21)10-17(7-11)27-19-9-12(2)8-18(25-14(4)22)20(19)26-15(5)23/h6-10H,1-5H3 |
| InChIKey |
WXNZOWKJIFKLMC-UHFFFAOYSA-N |
| Molecular Weight |
372.373 g/mol |
| SMILES |
C1(=C(C(=CC(=C1)C)OC1=CC(=CC(=C1)C)OC(C)=O)OC(C)=O)OC(C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.886399 |
