| SpectraBase Spectrum ID |
ERR3yVaD2Mj |
| Name |
1,2-Benzenediol, o-(4-methoxybenzoyl)-o'-(4-methylbenzoyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
362.115423675 u |
| Formula |
C22H18O5 |
| InChI |
InChI=1S/C22H18O5/c1-15-7-9-16(10-8-15)21(23)26-19-5-3-4-6-20(19)27-22(24)17-11-13-18(25-2)14-12-17/h3-14H,1-2H3 |
| InChIKey |
HZQRFEKASXTPSF-UHFFFAOYSA-N |
| Molecular Weight |
362.381 g/mol |
| SMILES |
CC1=CC=C(C(OC=2C(=CC=CC2)OC(C2=CC=C(OC)C=C2)=O)=O)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.830687 |
