| SpectraBase Spectrum ID |
31lDF5ascda |
| Name |
3-(2-Keto-2-methoxy-ethyl)-1H-indene-2-carboxylic acid methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
246.089208927 u |
| Formula |
C14H14O4 |
| InChI |
InChI=1S/C14H14O4/c1-17-13(15)8-11-10-6-4-3-5-9(10)7-12(11)14(16)18-2/h3-6H,7-8H2,1-2H3 |
| InChIKey |
FWWWALXCJDAPHM-UHFFFAOYSA-N |
| Molecular Weight |
246.262 g/mol |
| SMILES |
C1C(=C(C=2C=CC=CC12)CC(=O)OC)C(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.803041 |
