| SpectraBase Spectrum ID |
96my5iO1JXU |
| Name |
Dimethyl 1-oxoindan-5,6-dicarboxylate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
248.068473481 u |
| Formula |
C13H12O5 |
| InChI |
InChI=1S/C13H12O5/c1-17-12(15)9-5-7-3-4-11(14)8(7)6-10(9)13(16)18-2/h5-6H,3-4H2,1-2H3 |
| InChIKey |
CXLWPVOTUZHZHP-UHFFFAOYSA-N |
| Molecular Weight |
248.234 g/mol |
| SMILES |
C=1(C(=CC2=C(C1)C(CC2)=O)C(=O)OC)C(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.914526 |
