| SpectraBase Spectrum ID |
2hQ1ooIjIts |
| Name |
Phthalic acid, 2,6-dimethoxyphenyl phenyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
378.110338294 u |
| Formula |
C22H18O6 |
| InChI |
InChI=1S/C22H18O6/c1-25-18-13-8-14-19(26-2)20(18)28-22(24)17-12-7-6-11-16(17)21(23)27-15-9-4-3-5-10-15/h3-14H,1-2H3 |
| InChIKey |
OBBOGYBIENYYNG-UHFFFAOYSA-N |
| Molecular Weight |
378.380 g/mol |
| SMILES |
C1=CC=C(C=C1)OC(C1=C(C(OC2=C(C=CC=C2OC)OC)=O)C=CC=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.887894 |
