| SpectraBase Compound ID | 7iIcCcISy17 |
|---|---|
| InChI | InChI=1S/C12H22O/c1-10(2)6-5-7-11(3)8-9-12(4)13/h6,11H,5,7-9H2,1-4H3 |
| InChIKey | GLAPMFHVIBLHNS-UHFFFAOYSA-N |
| Mol Weight | 182.31 g/mol |
| Molecular Formula | C12H22O |
| Exact Mass | 182.167065 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 5uJ6d7fP8Sj |
|---|---|
| Name | 5,9-Dimethyldec-8-en-2-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 182.167065327 u |
| Formula | C12H22O |
| InChI | InChI=1S/C12H22O/c1-10(2)6-5-7-11(3)8-9-12(4)13/h6,11H,5,7-9H2,1-4H3 |
| InChIKey | GLAPMFHVIBLHNS-UHFFFAOYSA-N |
| Molecular Weight | 182.307 g/mol |
| SMILES | C(C(C)CCC(=O)C)CC=C(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.990019 |