| SpectraBase Spectrum ID |
EqBtcwimc2P |
| Name |
6-Ethyl-7-hydroxy-4-phenyl-2H-1-benzopyran-2-one, 2-methylpropionate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
336.136159120 u |
| Formula |
C21H20O4 |
| InChI |
InChI=1S/C21H20O4/c1-4-14-10-17-16(15-8-6-5-7-9-15)11-20(22)24-19(17)12-18(14)25-21(23)13(2)3/h5-13H,4H2,1-3H3 |
| InChIKey |
SKSVNDZNVBQXPX-UHFFFAOYSA-N |
| Molecular Weight |
336.387 g/mol |
| SMILES |
C1=2OC(C=C(C2C=C(C(=C1)OC(C(C)C)=O)CC)C1=CC=CC=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.872517 |
