| SpectraBase Compound ID | B2HGdO6PSx9 |
|---|---|
| InChI | InChI=1S/C9H18O/c1-8(2)5-4-6-9(3)7-10/h9-10H,1,4-7H2,2-3H3/t9-/m0/s1 |
| InChIKey | GUIBQTSZYLPXBH-VIFPVBQESA-N |
| Mol Weight | 142.24 g/mol |
| Molecular Formula | C9H18O |
| Exact Mass | 142.135765 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | JEpugplDMzz |
|---|---|
| Name | (2S)-2,6-Dimethyl-6-hepten-1-ol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 142.135765199 u |
| Formula | C9H18O |
| InChI | InChI=1S/C9H18O/c1-8(2)5-4-6-9(3)7-10/h9-10H,1,4-7H2,2-3H3/t9-/m0/s1 |
| InChIKey | GUIBQTSZYLPXBH-VIFPVBQESA-N |
| Molecular Weight | 142.242 g/mol |
| SMILES | C(=C)(CCC[C@@](CO)(C)[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.808323 |