| SpectraBase Compound ID | 380XfSrjyYW |
|---|---|
| InChI | InChI=1S/C13H24O2/c1-11(2)8-6-5-7-9-15-13(14)10-12(3)4/h6,8,11-12H,5,7,9-10H2,1-4H3/b8-6+ |
| InChIKey | BIMWVGHGEVBMJM-SOFGYWHQSA-N |
| Mol Weight | 212.33 g/mol |
| Molecular Formula | C13H24O2 |
| Exact Mass | 212.17763 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CMJZIOzb7l6 |
|---|---|
| Name | 6-Methylhept-4-en-1-yl 3-methylbutanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 212.177630011 u |
| Formula | C13H24O2 |
| InChI | InChI=1S/C13H24O2/c1-11(2)8-6-5-7-9-15-13(14)10-12(3)4/h6,8,11-12H,5,7,9-10H2,1-4H3/b8-6+ |
| InChIKey | BIMWVGHGEVBMJM-SOFGYWHQSA-N |
| Molecular Weight | 212.333 g/mol |
| SMILES | C(CC(C)C)(=O)OCCC\C=C\C(C)C |