| SpectraBase Compound ID | 2wv1XWfIC93 |
|---|---|
| InChI | InChI=1S/C6H14O2/c1-3-4-6(8)5(2)7/h5-8H,3-4H2,1-2H3 |
| InChIKey | QCIYAEYRVFUFAP-UHFFFAOYSA-N |
| Mol Weight | 118.18 g/mol |
| Molecular Formula | C6H14O2 |
| Exact Mass | 118.09938 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 7dlqKO3dLFO |
|---|---|
| Name | (ss)- or (rr)-2,3-Hexanediol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 118.099379689 u |
| Formula | C6H14O2 |
| InChI | InChI=1S/C6H14O2/c1-3-4-6(8)5(2)7/h5-8H,3-4H2,1-2H3 |
| InChIKey | QCIYAEYRVFUFAP-UHFFFAOYSA-N |
| Molecular Weight | 118.176 g/mol |
| SMILES | CCCC(C(C)O)O |