| SpectraBase Spectrum ID |
7tPW6LPtfa8 |
| Name |
Methyl 6-methoxy-1-oxoindan-4-carboxylate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
220.073558862 u |
| Formula |
C12H12O4 |
| InChI |
InChI=1S/C12H12O4/c1-15-7-5-9-8(3-4-11(9)13)10(6-7)12(14)16-2/h5-6H,3-4H2,1-2H3 |
| InChIKey |
XJJRBKSEVGWRSQ-UHFFFAOYSA-N |
| Molecular Weight |
220.224 g/mol |
| SMILES |
C1=2C(C(=O)OC)=CC(=CC2C(=O)CC1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.942669 |
