| SpectraBase Compound ID | BOEJvN3aHmx |
|---|---|
| InChI | InChI=1S/C9H16O2/c1-3-4-8-7(2)5-6-9(10)11-8/h7-8H,3-6H2,1-2H3/t7-,8+/m1/s1 |
| InChIKey | VTTKCOWNDWSCFA-SFYZADRCSA-N |
| Mol Weight | 156.22 g/mol |
| Molecular Formula | C9H16O2 |
| Exact Mass | 156.11503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FKn6iRGirwP |
|---|---|
| Name | (5R*,6S*)-5-Methyl-6-propyl-tetrahydropyran-2-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 156.115029753 u |
| Formula | C9H16O2 |
| InChI | InChI=1S/C9H16O2/c1-3-4-8-7(2)5-6-9(10)11-8/h7-8H,3-6H2,1-2H3/t7-,8+/m1/s1 |
| InChIKey | VTTKCOWNDWSCFA-SFYZADRCSA-N |
| Molecular Weight | 156.225 g/mol |
| SMILES | C1(O[C@]([C@@](CC1)(C)[H])(CCC)[H])=O |