![1-[(1E)-1-cyclododecenyl]ethanone](/api/spectrum/L8XIsTYCKni/structure.png?h=300&w=458 "1-[(1E)-1-cyclododecenyl]ethanone")
| SpectraBase Compound ID | 8gMpyv8O4TY |
|---|---|
| InChI | InChI=1S/C14H24O/c1-13(15)14-11-9-7-5-3-2-4-6-8-10-12-14/h11H,2-10,12H2,1H3/b14-11+ |
| InChIKey | MLCBOXBUBJRZHC-SDNWHVSQSA-N |
| Mol Weight | 208.34 g/mol |
| Molecular Formula | C14H24O |
| Exact Mass | 208.182715 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | L8XIsTYCKni |
|---|---|
| Name | 1-[(1E)-1-Cyclododecenyl]ethanone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 208.182715392 u |
| Formula | C14H24O |
| InChI | InChI=1S/C14H24O/c1-13(15)14-11-9-7-5-3-2-4-6-8-10-12-14/h11H,2-10,12H2,1H3/b14-11+ |
| InChIKey | MLCBOXBUBJRZHC-SDNWHVSQSA-N |
| Molecular Weight | 208.345 g/mol |
| SMILES | C(\C1=C\CCCCCCCCCC1)(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.949755 |