| SpectraBase Spectrum ID |
6S1yeQPMMvc |
| Name |
1-(3,4-Dihydro-2,2-dimethyl-7-hydroxy-2H-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 |
308.141244501 u |
| Formula |
C20H20O3 |
| InChI |
InChI=1S/C20H20O3/c1-20(2)11-10-15-12-16(18(22)13-19(15)23-20)17(21)9-8-14-6-4-3-5-7-14/h3-9,12-13,22H,10-11H2,1-2H3/b9-8+ |
| InChIKey |
XDXWKSMYQWSEJE-CMDGGOBGSA-N |
| Molecular Weight |
308.377 g/mol |
| SMILES |
C=1C2=C(C=C(O)C1C(=O)\C=C\C=1C=CC=CC1)OC(CC2)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.945104 |
