| SpectraBase Compound ID | 601FtFaIYnx |
|---|---|
| InChI | InChI=1S/C13H24O3/c1-5-12(14)16-10-8-11(2)7-6-9-13(3,4)15/h8,15H,5-7,9-10H2,1-4H3/b11-8+ |
| InChIKey | GTLKMJOGIBUONL-DHZHZOJOSA-N |
| Mol Weight | 228.33 g/mol |
| Molecular Formula | C13H24O3 |
| Exact Mass | 228.172545 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5LkwRURt7Se |
|---|---|
| Name | 7-Hydroxy-3,7-dimethyl-2-octen-1-yl propionate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 228.172544630 u |
| Formula | C13H24O3 |
| InChI | InChI=1S/C13H24O3/c1-5-12(14)16-10-8-11(2)7-6-9-13(3,4)15/h8,15H,5-7,9-10H2,1-4H3/b11-8+ |
| InChIKey | GTLKMJOGIBUONL-DHZHZOJOSA-N |
| Molecular Weight | 228.332 g/mol |
| SMILES | C(CC)(=O)OC\C=C\(CCCC(C)(C)O)C |