| SpectraBase Compound ID | 8ekdeAfh7pm |
|---|---|
| InChI | InChI=1S/C9H18O2/c1-8(2)5-4-6-9(3,11)7-10/h5,10-11H,4,6-7H2,1-3H3/t9-/m1/s1 |
| InChIKey | ZAPOEKZHEPVHAT-SECBINFHSA-N |
| Mol Weight | 158.24 g/mol |
| Molecular Formula | C9H18O2 |
| Exact Mass | 158.13068 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 6SWgtHvWWZR |
|---|---|
| Name | (2R)-2,6-Dimethyl-5-heptene-1,2-diol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 158.130679818 u |
| Formula | C9H18O2 |
| InChI | InChI=1S/C9H18O2/c1-8(2)5-4-6-9(3,11)7-10/h5,10-11H,4,6-7H2,1-3H3/t9-/m1/s1 |
| InChIKey | ZAPOEKZHEPVHAT-SECBINFHSA-N |
| Molecular Weight | 158.241 g/mol |
| SMILES | C(=CCC[C@@](O)(CO)C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.93795 |