| SpectraBase Spectrum ID |
BBRBeIJHWHq |
| Name |
5-Ethyl-3-methyl-5-phenyl-2(5H)-furanone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
202.099379689 u |
| Formula |
C13H14O2 |
| InChI |
InChI=1S/C13H14O2/c1-3-13(9-10(2)12(14)15-13)11-7-5-4-6-8-11/h4-9H,3H2,1-2H3 |
| InChIKey |
UECOCLAQYAEXDO-UHFFFAOYSA-N |
| Molecular Weight |
202.253 g/mol |
| SMILES |
C1(OC(=O)C(=C1)C)(C=1C=CC=CC1)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.88447 |