| SpectraBase Spectrum ID |
IDOyGxhqQ6V |
| Name |
9(10H)-Anthracenone, 10-benzoyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
298.099379689 u |
| Formula |
C21H14O2 |
| InChI |
InChI=1S/C21H14O2/c22-20(14-8-2-1-3-9-14)19-15-10-4-6-12-17(15)21(23)18-13-7-5-11-16(18)19/h1-13,19H |
| InChIKey |
UBNPGDBUJBXYRX-UHFFFAOYSA-N |
| SMILES |
C1(C=2C(=CC=CC2)C(C2=C1C=CC=C2)=O)C(=O)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.844333 |
