![5,6,6-Trimethylbicyclo[3.2.0]heptan-2-one](/api/spectrum/JdlyN3myJ5t/structure.png?h=300&w=458 "5,6,6-Trimethylbicyclo[3.2.0]heptan-2-one")
| SpectraBase Compound ID | EEniZgcHqoq |
|---|---|
| InChI | InChI=1S/C10H16O/c1-9(2)6-7-8(11)4-5-10(7,9)3/h7H,4-6H2,1-3H3 |
| InChIKey | QVLJAHLQRZVTBC-UHFFFAOYSA-N |
| Mol Weight | 152.24 g/mol |
| Molecular Formula | C10H16O |
| Exact Mass | 152.120115 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | JdlyN3myJ5t |
|---|---|
| Name | 5,6,6-Trimethylbicyclo[3.2.0]heptan-2-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 152.120115134 u |
| Formula | C10H16O |
| InChI | InChI=1S/C10H16O/c1-9(2)6-7-8(11)4-5-10(7,9)3/h7H,4-6H2,1-3H3 |
| InChIKey | QVLJAHLQRZVTBC-UHFFFAOYSA-N |
| Molecular Weight | 152.237 g/mol |
| SMILES | C12(C(C(=O)CC2)CC1(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.977852 |