| SpectraBase Spectrum ID |
75HBtCke6cW |
| Name |
8-Cinnamoyl-5,7-dihydroxy-2,2,6-trimethylchromene, 2ac derivative |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
420.157288487 u |
| Formula |
C25H24O6 |
| InChI |
InChI=1S/C25H24O6/c1-15-22(29-16(2)26)19-13-14-25(4,5)31-24(19)21(23(15)30-17(3)27)20(28)12-11-18-9-7-6-8-10-18/h6-14H,1-5H3/b12-11+ |
| InChIKey |
DFCICNLDEYNHQV-VAWYXSNFSA-N |
| Molecular Weight |
420.461 g/mol |
| SMILES |
C1(C=CC2=C(C(=C(C(=C2O1)C(\C=C\C1=CC=CC=C1)=O)OC(C)=O)C)OC(=O)C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.964566 |
