| SpectraBase Compound ID | 45rD6qftXK7 |
|---|---|
| InChI | InChI=1S/C15H28O3/c1-4-5-6-7-8-9-10-11-12-15(17)13(2)18-14(3)16/h13H,4-12H2,1-3H3/t13-/m0/s1 |
| InChIKey | VCMHMCNJVPGQBN-ZDUSSCGKSA-N |
| Mol Weight | 256.39 g/mol |
| Molecular Formula | C15H28O3 |
| Exact Mass | 256.203845 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HP6jeVXPTli |
|---|---|
| Name | (S)-2-Acetoxy-3-tridecanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 256.203844759 u |
| Formula | C15H28O3 |
| InChI | InChI=1S/C15H28O3/c1-4-5-6-7-8-9-10-11-12-15(17)13(2)18-14(3)16/h13H,4-12H2,1-3H3/t13-/m0/s1 |
| InChIKey | VCMHMCNJVPGQBN-ZDUSSCGKSA-N |
| Molecular Weight | 256.386 g/mol |
| SMILES | C(O[C@](C(=O)CCCCCCCCCC)(C)[H])(=O)C |