![6H-Benz[de]anthracen-6-one](/api/spectrum/4to5FYFeI7D/structure.png?h=300&w=458 "6H-Benz[de]anthracen-6-one")
| SpectraBase Compound ID | FVahKCGFvF7 |
|---|---|
| InChI | InChI=1S/C17H10O/c18-16-9-8-11-5-3-7-14-13-6-2-1-4-12(13)10-15(16)17(11)14/h1-10H |
| InChIKey | HXXDBVYUPVEGRS-UHFFFAOYSA-N |
| Mol Weight | 230.27 g/mol |
| Molecular Formula | C17H10O |
| Exact Mass | 230.073165 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4to5FYFeI7D |
|---|---|
| Name | 6H-Benz[de]anthracen-6-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 230.073164941 u |
| Formula | C17H10O |
| InChI | InChI=1S/C17H10O/c18-16-9-8-11-5-3-7-14-13-6-2-1-4-12(13)10-15(16)17(11)14/h1-10H |
| InChIKey | HXXDBVYUPVEGRS-UHFFFAOYSA-N |
| Molecular Weight | 230.266 g/mol |
| SMILES | C1=CC=CC2=C1C=C1C(C=CC=3C1=C2C=CC3)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.927542 |