| SpectraBase Compound ID | 2OiozGAaeh3 |
|---|---|
| InChI | InChI=1S/C8H18O2/c1-2-3-4-5-8(10)6-7-9/h8-10H,2-7H2,1H3 |
| InChIKey | DCTMXCOHGKSXIZ-UHFFFAOYSA-N |
| Mol Weight | 146.23 g/mol |
| Molecular Formula | C8H18O2 |
| Exact Mass | 146.13068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6eKC4MbpEmR |
|---|---|
| Name | 1,3-Octanediol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 146.130679818 u |
| Formula | C8H18O2 |
| InChI | InChI=1S/C8H18O2/c1-2-3-4-5-8(10)6-7-9/h8-10H,2-7H2,1H3 |
| InChIKey | DCTMXCOHGKSXIZ-UHFFFAOYSA-N |
| Molecular Weight | 146.230 g/mol |
| SMILES | C(C(CCO)O)CCCC |