SpectraBase Spectrum ID |
AOIQpyBElMl |
Name |
9-Oxofluorene-4-carboxylic acid, methyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
238.062994179 u |
Formula |
C15H10O3 |
InChI |
InChI=1S/C15H10O3/c1-18-15(17)12-8-4-7-11-13(12)9-5-2-3-6-10(9)14(11)16/h2-8H,1H3 |
InChIKey |
WSTDJPDRIAZQON-UHFFFAOYSA-N |
Molecular Weight |
238.242 g/mol |
SMILES |
C1=CC=CC2=C1C=1C(=CC=CC1C2=O)C(=O)OC |
Spectrum/Structure Validation Score (Raman) |
0.798127 |