| SpectraBase Spectrum ID |
5RI5bEkxNYO |
| Name |
o-(3-oxo-1-Indanyl)benzoic acid, methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
266.094294308 u |
| Formula |
C17H14O3 |
| InChI |
InChI=1S/C17H14O3/c1-20-17(19)14-9-5-3-7-12(14)15-10-16(18)13-8-4-2-6-11(13)15/h2-9,15H,10H2,1H3 |
| InChIKey |
FZKADBIXGMTXIY-UHFFFAOYSA-N |
| Molecular Weight |
266.296 g/mol |
| SMILES |
C1=C(C(=CC=C1)C1C=2C=CC=CC2C(C1)=O)C(=O)OC |
| Spectrum/Structure Validation Score (Raman) |
0.883658 |
