| SpectraBase Spectrum ID |
96Eo5QnZ2Qy |
| Name |
1,3-Benzenediol, o-propionyl-o'-(3-methylbenzoyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
284.104858991 u |
| Formula |
C17H16O4 |
| InChI |
InChI=1S/C17H16O4/c1-3-16(18)20-14-8-5-9-15(11-14)21-17(19)13-7-4-6-12(2)10-13/h4-11H,3H2,1-2H3 |
| InChIKey |
AEFVZBFDYHCZPE-UHFFFAOYSA-N |
| SMILES |
C1=C(C=CC=C1OC(=O)C1=CC(C)=CC=C1)OC(CC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.801487 |
