| SpectraBase Compound ID | Io5FuAXsssK |
|---|---|
| InChI | InChI=1S/C12H20O/c1-10(2)6-5-7-11(3)8-9-12(4)13/h6H,3,5,7-9H2,1-2,4H3 |
| InChIKey | NKMLDIISNIAWFB-UHFFFAOYSA-N |
| Mol Weight | 180.29 g/mol |
| Molecular Formula | C12H20O |
| Exact Mass | 180.151415 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3jPvqGgz1qj |
|---|---|
| Name | 9-Methyl-5-methylidene-dec-8-en-2-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 180.151415263 u |
| Formula | C12H20O |
| InChI | InChI=1S/C12H20O/c1-10(2)6-5-7-11(3)8-9-12(4)13/h6H,3,5,7-9H2,1-2,4H3 |
| InChIKey | NKMLDIISNIAWFB-UHFFFAOYSA-N |
| Molecular Weight | 180.291 g/mol |
| SMILES | C(=O)(CCC(=C)CCC=C(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.970422 |