| SpectraBase Compound ID | 9AHzRAuc6n5 |
|---|---|
| InChI | InChI=1S/C13H24O/c1-11(2)7-5-8-12(3)9-6-10-13(4)14/h7,12H,5-6,8-10H2,1-4H3 |
| InChIKey | LGVYUZVANMHKHV-UHFFFAOYSA-N |
| Mol Weight | 196.33 g/mol |
| Molecular Formula | C13H24O |
| Exact Mass | 196.182715 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4D7mcZnxuco |
|---|---|
| Name | 9-Undecen-2-one, 6,10-dimethyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.182715392 u |
| Formula | C13H24O |
| InChI | InChI=1S/C13H24O/c1-11(2)7-5-8-12(3)9-6-10-13(4)14/h7,12H,5-6,8-10H2,1-4H3 |
| InChIKey | LGVYUZVANMHKHV-UHFFFAOYSA-N |
| Molecular Weight | 196.334 g/mol |
| SMILES | C(C(CCCC(C)=O)C)CC=C(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.967879 |