| SpectraBase Spectrum ID |
GTFABlN7paX |
| Name |
5H-Dibenzo[A,D]cyclohepten-5-one, 2-chloro-10,11-dihydro- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
242.049842673 u |
| Formula |
C15H11ClO |
| InChI |
InChI=1S/C15H11ClO/c16-12-7-8-14-11(9-12)6-5-10-3-1-2-4-13(10)15(14)17/h1-4,7-9H,5-6H2 |
| InChIKey |
NOXZOHAVIZPPCW-UHFFFAOYSA-N |
| Molecular Weight |
242.705 g/mol |
| SMILES |
C12=C(C=CC(=C2)Cl)C(C=2C(CC1)=CC=CC2)=O |
| Spectrum/Structure Validation Score (Raman) |
0.993046 |
![5H-Dibenzo[a,d]cyclohepten-5-one, 2-chloro-10,11-dihydro-](/api/spectrum/GTFABlN7paX/structure.png?h=300&w=458 "5H-Dibenzo[a,d]cyclohepten-5-one, 2-chloro-10,11-dihydro-")
