SpectraBase Spectrum ID |
Fkhj6vVD3eL |
Name |
(E)-1-(5,8-Dihydroxy-2,2-dimethyl-1-benzopyran-6-yl)-3-phenyl-2-propen-1-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
322.120509056 u |
Formula |
C20H18O4 |
InChI |
InChI=1S/C20H18O4/c1-20(2)11-10-14-18(23)15(12-17(22)19(14)24-20)16(21)9-8-13-6-4-3-5-7-13/h3-12,22-23H,1-2H3/b9-8+ |
InChIKey |
HZEJNIAQUFJSBF-CMDGGOBGSA-N |
Molecular Weight |
322.360 g/mol |
SMILES |
C=12C(OC(C=C2)(C)C)=C(O)C=C(C1O)C(\C=C\C=1C=CC=CC1)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.953294 |