| SpectraBase Compound ID | Bcq2JRZjxCZ |
|---|---|
| InChI | InChI=1S/C17H26O/c1-2-3-4-5-6-7-8-12-15-17(18)16-13-10-9-11-14-16/h9-11,13-14H,2-8,12,15H2,1H3 |
| InChIKey | LHJBFOGCFZHBAJ-UHFFFAOYSA-N |
| Mol Weight | 246.39 g/mol |
| Molecular Formula | C17H26O |
| Exact Mass | 246.198365 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | LKJPNmCN8T1 |
|---|---|
| Name | Undecanophenone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 246.198365456 u |
| Formula | C17H26O |
| InChI | InChI=1S/C17H26O/c1-2-3-4-5-6-7-8-12-15-17(18)16-13-10-9-11-14-16/h9-11,13-14H,2-8,12,15H2,1H3 |
| InChIKey | LHJBFOGCFZHBAJ-UHFFFAOYSA-N |
| Molecular Weight | 246.394 g/mol |
| SMILES | C(CC)CCCCCCCC(C1=CC=CC=C1)=O |
| Spectrum/Structure Validation Score (Raman) | 0.989866 |