| SpectraBase Compound ID | 6MvhigmH9Jq |
|---|---|
| InChI | InChI=1S/C13H26O4/c1-3-4-5-6-7-9-17-13(15)11-12(14)8-10-16-2/h12,14H,3-11H2,1-2H3 |
| InChIKey | YFELLKLSWXVTKU-UHFFFAOYSA-N |
| Mol Weight | 246.35 g/mol |
| Molecular Formula | C13H26O4 |
| Exact Mass | 246.183109 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KQEdR747Jh9 |
|---|---|
| Name | Heptyl (3s)-3-hydroxy-5-methoxypentanoate |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H26O4 |
| InChI | InChI=1S/C13H26O4/c1-3-4-5-6-7-9-17-13(15)11-12(14)8-10-16-2/h12,14H,3-11H2,1-2H3 |
| InChIKey | YFELLKLSWXVTKU-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 246.347 g/mol |
| SMILES | OC(CC(OCCCCCCC)=O)CCOC |
| SPLASH | splash10-052n-9300000000-73f2fc377047c41ed93c |
| Source of Spectrum | SRH-2022-7270-0 |
| Wiley ID | 1829069 |