| SpectraBase Spectrum ID |
68aHOoLs4ku |
| Name |
6-Ethyl-7-hydroxy-4-phenyl-2H-1-benzopyran-2-one, trimethylacetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
350.151809184 u |
| Formula |
C22H22O4 |
| InChI |
InChI=1S/C22H22O4/c1-5-14-11-17-16(15-9-7-6-8-10-15)12-20(23)25-19(17)13-18(14)26-21(24)22(2,3)4/h6-13H,5H2,1-4H3 |
| InChIKey |
CDMCGVLESRMJAO-UHFFFAOYSA-N |
| Molecular Weight |
350.414 g/mol |
| SMILES |
C1=2OC(C=C(C2C=C(C(=C1)OC(C(C)(C)C)=O)CC)C1=CC=CC=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.917705 |
