| SpectraBase Spectrum ID |
4aZHUbxMrJX |
| Name |
2-(Xanthen-9-yl)-1,3-indandione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
326.094294308 u |
| Formula |
C22H14O3 |
| InChI |
InChI=1S/C22H14O3/c23-21-13-7-1-2-8-14(13)22(24)20(21)19-15-9-3-5-11-17(15)25-18-12-6-4-10-16(18)19/h1-12,19-20H |
| InChIKey |
ZFIMNJFROFDYCI-UHFFFAOYSA-N |
| Molecular Weight |
326.351 g/mol |
| SMILES |
C=12C=CC=CC1C(C(C2=O)C1C=2C=CC=CC2OC=2C=CC=CC12)=O |
| Spectrum/Structure Validation Score (Raman) |
0.781003 |
