| SpectraBase Compound ID | 4w1sjM6DSBi |
|---|---|
| InChI | InChI=1S/C6H14O/c1-5(2)6(3)4-7/h5-7H,4H2,1-3H3 |
| InChIKey | SXSWMAUXEHKFGX-UHFFFAOYSA-N |
| Mol Weight | 102.18 g/mol |
| Molecular Formula | C6H14O |
| Exact Mass | 102.104465 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | FltQNoe2PvM |
|---|---|
| Name | 2,3-Dimethyl-1-butanol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 102.104465070 u |
| Formula | C6H14O |
| InChI | InChI=1S/C6H14O/c1-5(2)6(3)4-7/h5-7H,4H2,1-3H3 |
| InChIKey | SXSWMAUXEHKFGX-UHFFFAOYSA-N |
| Molecular Weight | 102.177 g/mol |
| SMILES | OCC(C(C)C)C |
| Spectrum/Structure Validation Score (Raman) | 0.981924 |