SpectraBase Spectrum ID |
E3x8a4jQE0F |
Name |
1,2-Benzenediol, o-(4-methoxybenzoyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
244.073558862 u |
Formula |
C14H12O4 |
InChI |
InChI=1S/C14H12O4/c1-17-11-8-6-10(7-9-11)14(16)18-13-5-3-2-4-12(13)15/h2-9,15H,1H3 |
InChIKey |
FRCRTINITKGBKR-UHFFFAOYSA-N |
Molecular Weight |
244.246 g/mol |
SMILES |
COC1=CC=C(C(OC2=CC=CC=C2O)=O)C=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.866186 |