| SpectraBase Spectrum ID |
EMk2Bu7IjeB |
| Name |
Dimethyl 1-(3,4-dimethylphenyl)-naphthalene-2,3-dicarboxylate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
348.136159120 u |
| Formula |
C22H20O4 |
| InChI |
InChI=1S/C22H20O4/c1-13-9-10-16(11-14(13)2)19-17-8-6-5-7-15(17)12-18(21(23)25-3)20(19)22(24)26-4/h5-12H,1-4H3 |
| InChIKey |
DSRPCDYJCHAKSM-UHFFFAOYSA-N |
| Molecular Weight |
348.398 g/mol |
| SMILES |
C1(=C(C(=C2C(=C1)C=CC=C2)C1=CC(=C(C=C1)C)C)C(OC)=O)C(OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.932728 |
