![6,7-Dihydrodibenz[b,d]oxepin-6-one](/api/spectrum/5T7qHwZfQFM/structure.png?h=300&w=458 "6,7-Dihydrodibenz[b,d]oxepin-6-one")
| SpectraBase Compound ID | 3zrsCweEloS |
|---|---|
| InChI | InChI=1S/C14H10O2/c15-13-9-16-14-8-4-3-7-12(14)10-5-1-2-6-11(10)13/h1-8H,9H2 |
| InChIKey | KLESETVYNCDHFF-UHFFFAOYSA-N |
| Mol Weight | 210.23 g/mol |
| Molecular Formula | C14H10O2 |
| Exact Mass | 210.06808 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 5T7qHwZfQFM |
|---|---|
| Name | 6,7-Dihydrodibenz[B,D]oxepin-6-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 210.068079560 u |
| Formula | C14H10O2 |
| InChI | InChI=1S/C14H10O2/c15-13-9-16-14-8-4-3-7-12(14)10-5-1-2-6-11(10)13/h1-8H,9H2 |
| InChIKey | KLESETVYNCDHFF-UHFFFAOYSA-N |
| Molecular Weight | 210.232 g/mol |
| SMILES | C=12C(C(COC=3C2=CC=CC3)=O)=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.94394 |