| SpectraBase Compound ID | 62nGB2EDXhv |
|---|---|
| InChI | InChI=1S/C10H20O2/c1-5-8(2)6-7-9(11)10(3,4)12/h5,8-9,11-12H,1,6-7H2,2-4H3 |
| InChIKey | SKKRPDNROZIXRQ-UHFFFAOYSA-N |
| Mol Weight | 172.27 g/mol |
| Molecular Formula | C10H20O2 |
| Exact Mass | 172.14633 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | FiMxF6QoZuq |
|---|---|
| Name | (6S)-2,6-Dimethyl-7-octene-2,3-diol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 172.146329882 u |
| Formula | C10H20O2 |
| InChI | InChI=1S/C10H20O2/c1-5-8(2)6-7-9(11)10(3,4)12/h5,8-9,11-12H,1,6-7H2,2-4H3 |
| InChIKey | SKKRPDNROZIXRQ-UHFFFAOYSA-N |
| Molecular Weight | 172.268 g/mol |
| SMILES | C(C(O)(C)C)(O)CCC(C=C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.944828 |