| SpectraBase Compound ID | D5unim6EZUe |
|---|---|
| InChI | InChI=1S/C15H16O/c1-13(14(2)16)9-5-3-6-10-15-11-7-4-8-12-15/h3-12H,1-2H3/b5-3+,10-6+,13-9+ |
| InChIKey | DLEPTASFXXJVDU-XVZDYSDNSA-N |
| Mol Weight | 212.29 g/mol |
| Molecular Formula | C15H16O |
| Exact Mass | 212.120115 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | LwALVUzHJvq |
|---|---|
| Name | Lignarenone B |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 212.120115134 u |
| Formula | C15H16O |
| InChI | InChI=1S/C15H16O/c1-13(14(2)16)9-5-3-6-10-15-11-7-4-8-12-15/h3-12H,1-2H3/b5-3+,10-6+,13-9+ |
| InChIKey | DLEPTASFXXJVDU-XVZDYSDNSA-N |
| Molecular Weight | 212.292 g/mol |
| SMILES | C(\C(=C\C=C\C=C\C1=CC=CC=C1)C)(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.948481 |