| SpectraBase Compound ID | Cnbes5KrknK |
|---|---|
| InChI | InChI=1S/C7H12O/c1-2-3-4-5-6-7-8/h8H,2,5-7H2,1H3 |
| InChIKey | XLTJVODPJJDQNG-UHFFFAOYSA-N |
| Mol Weight | 112.17 g/mol |
| Molecular Formula | C7H12O |
| Exact Mass | 112.088815 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9JFi6rq6A7E |
|---|---|
| Name | 4-HEPTYNOL |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C7H12O/c1-2-3-4-5-6-7-8/h8H,2,5-7H2,1H3 |
| InChIKey | XLTJVODPJJDQNG-UHFFFAOYSA-N |
| Literature Reference | J.NIEL UNILEVER VLAARDINGEN |
| Solvent | Chloroform-d |