| SpectraBase Spectrum ID |
4ehurkI6XK7 |
| Name |
3',6'-Dibenzoyl-4-methyl-fluorescein |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
554.136553041 u |
| Formula |
C35H22O7 |
| InChI |
InChI=1S/C35H22O7/c1-21-12-15-27-26(18-21)34(38)42-35(27)28-16-13-24(39-32(36)22-8-4-2-5-9-22)19-30(28)41-31-20-25(14-17-29(31)35)40-33(37)23-10-6-3-7-11-23/h2-20H,1H3 |
| InChIKey |
YTWCNLVJCBWLIK-UHFFFAOYSA-N |
| Molecular Weight |
554.554 g/mol |
| SMILES |
C12=CC=C(C=C2OC=2C(C11C3=CC=C(C=C3C(O1)=O)C)=CC=C(C2)OC(=O)C1=CC=CC=C1)OC(=O)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.958096 |
