![5H-Dibenz[b,f]azepine, chloro-](/api/spectrum/7A7URcRKPis/structure.png?h=300&w=458 "5H-Dibenz[b,f]azepine, chloro-")
| SpectraBase Compound ID | EpIwutv1d2X |
|---|---|
| InChI | InChI=1S/C14H10ClN/c15-12-6-3-5-11-9-8-10-4-1-2-7-13(10)16-14(11)12/h1-9,16H |
| InChIKey | CIUQATSBUIXXQZ-UHFFFAOYSA-N |
| Mol Weight | 227.69 g/mol |
| Molecular Formula | C14H10ClN |
| Exact Mass | 227.050177 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 7A7URcRKPis |
|---|---|
| Name | 5H-Dibenz[B,F]azepine, chloro- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 227.050177026 u |
| Formula | C14H10ClN |
| InChI | InChI=1S/C14H10ClN/c15-12-6-3-5-11-9-8-10-4-1-2-7-13(10)16-14(11)12/h1-9,16H |
| InChIKey | CIUQATSBUIXXQZ-UHFFFAOYSA-N |
| Molecular Weight | 227.694 g/mol |
| SMILES | C=12NC=3C(C=CC2=CC=CC1Cl)=CC=CC3 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.890015 |