| SpectraBase Spectrum ID |
AvAMSxH7mBi |
| Name |
4H-1-Benzopyran-4-one, 3-hydroxy-6-methyl-2-(4-methylphenyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
266.094294308 u |
| Formula |
C17H14O3 |
| InChI |
InChI=1S/C17H14O3/c1-10-3-6-12(7-4-10)17-16(19)15(18)13-9-11(2)5-8-14(13)20-17/h3-9,19H,1-2H3 |
| InChIKey |
OUNDHKZAGANSPX-UHFFFAOYSA-N |
| Molecular Weight |
266.296 g/mol |
| SMILES |
C12=C(C=CC(=C2)C)OC(=C(C1=O)O)C=1C=CC(=CC1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.948861 |
