| SpectraBase Compound ID | 8LzoVjAsG86 |
|---|---|
| InChI | InChI=1S/C15H26O2/c1-11(2)10-14(16)17-9-8-15(5)7-6-13(15)12(3)4/h11,13H,3,6-10H2,1-2,4-5H3 |
| InChIKey | YERQGDXMKGZPCZ-UHFFFAOYSA-N |
| Mol Weight | 238.37 g/mol |
| Molecular Formula | C15H26O2 |
| Exact Mass | 238.19328 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CsEzeGJuNoV |
|---|---|
| Name | Fragranyl isovaalerate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 238.193280075 u |
| Formula | C15H26O2 |
| InChI | InChI=1S/C15H26O2/c1-11(2)10-14(16)17-9-8-15(5)7-6-13(15)12(3)4/h11,13H,3,6-10H2,1-2,4-5H3 |
| InChIKey | YERQGDXMKGZPCZ-UHFFFAOYSA-N |
| Molecular Weight | 238.371 g/mol |
| SMILES | C(CC(C)C)(=O)OCCC1(C(CC1)C(=C)C)C |