| SpectraBase Spectrum ID |
28a1q44jhEN |
| Name |
Benzo[F][1,4]oxazepin-3-one, 4-(3,4-dichlorophenyl)-4,5-dihydro- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
307.016683996 u |
| Formula |
C15H11Cl2NO2 |
| InChI |
InChI=1S/C15H11Cl2NO2/c16-12-6-5-11(7-13(12)17)18-8-10-3-1-2-4-14(10)20-9-15(18)19/h1-7H,8-9H2 |
| InChIKey |
RYERMBUTEZEAFI-UHFFFAOYSA-N |
| Molecular Weight |
308.164 g/mol |
| SMILES |
C1=CC=C2C(=C1)CN(C=1C=CC(=C(C1)Cl)Cl)C(CO2)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.933068 |