| SpectraBase Spectrum ID |
Dy6Uvhy9jm7 |
| Name |
Propanedioic acid, (2-phenyl-1H-inden-1-yl)-, dimethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
322.120509056 u |
| Formula |
C20H18O4 |
| InChI |
InChI=1S/C20H18O4/c1-23-19(21)18(20(22)24-2)17-15-11-7-6-10-14(15)12-16(17)13-8-4-3-5-9-13/h3-12,17-18H,1-2H3 |
| InChIKey |
WTMUBQTUJFUKNQ-UHFFFAOYSA-N |
| Molecular Weight |
322.360 g/mol |
| SMILES |
C1=C2C(=CC=C1)C=C(C2C(C(OC)=O)C(OC)=O)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.943211 |
