| SpectraBase Compound ID | 1Vg0n2BLmUV |
|---|---|
| InChI | InChI=1S/C15H30O2/c1-4-6-8-9-10-11-13-15(12-7-5-2)17-14(3)16/h15H,4-13H2,1-3H3 |
| InChIKey | KGKQALFASDZUKG-UHFFFAOYSA-N |
| Mol Weight | 242.4 g/mol |
| Molecular Formula | C15H30O2 |
| Exact Mass | 242.22458 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3lVNO20KxpG |
|---|---|
| Name | 5-Acetoxytridecane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 242.224580204 u |
| Formula | C15H30O2 |
| InChI | InChI=1S/C15H30O2/c1-4-6-8-9-10-11-13-15(12-7-5-2)17-14(3)16/h15H,4-13H2,1-3H3 |
| InChIKey | KGKQALFASDZUKG-UHFFFAOYSA-N |
| Molecular Weight | 242.403 g/mol |
| SMILES | C(C(CCCCCCCC)OC(C)=O)CCC |