| SpectraBase Spectrum ID |
AFhErtDV5px |
| Name |
(+)-5-methyl-3-phenyl-1,3-dihydro-2-benzofuran-1-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
224.083729624 u |
| Formula |
C15H12O2 |
| InChI |
InChI=1S/C15H12O2/c1-10-7-8-12-13(9-10)14(17-15(12)16)11-5-3-2-4-6-11/h2-9,14H,1H3 |
| InChIKey |
FFAAGJTZBXNWNG-UHFFFAOYSA-N |
| Molecular Weight |
224.259 g/mol |
| SMILES |
C1(OC(C=2C1=CC=C(C2)C)C=1C=CC=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.913587 |
