| SpectraBase Compound ID | GYhTPppFhmT |
|---|---|
| InChI | InChI=1S/C11H16O/c1-5-9-6-10(12)8(2)7-11(9,3)4/h5,7,9H,1,6H2,2-4H3 |
| InChIKey | DABWZJNQPQGKBA-UHFFFAOYSA-N |
| Mol Weight | 164.25 g/mol |
| Molecular Formula | C11H16O |
| Exact Mass | 164.120115 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | H71B7rgvjpa |
|---|---|
| Name | 2,4,4-Trimethyl-5-vinylcyclohex-2-enone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 164.120115134 u |
| Formula | C11H16O |
| InChI | InChI=1S/C11H16O/c1-5-9-6-10(12)8(2)7-11(9,3)4/h5,7,9H,1,6H2,2-4H3 |
| InChIKey | DABWZJNQPQGKBA-UHFFFAOYSA-N |
| Molecular Weight | 164.248 g/mol |
| SMILES | C1(=O)C(=CC(C(C1)C=C)(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.985021 |