| SpectraBase Compound ID | H8YxuoCSByy |
|---|---|
| InChI | InChI=1S/C16H24O4/c1-3-4-5-6-7-8-9-20-16(19)15-13(17)10-12(2)11-14(15)18/h10-11,17-18H,3-9H2,1-2H3 |
| InChIKey | SLWOCPXSFQBEFG-UHFFFAOYSA-N |
| Mol Weight | 280.36 g/mol |
| Molecular Formula | C16H24O4 |
| Exact Mass | 280.167459 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HozmT0AaPeI |
|---|---|
| Name | Benzoic acid, 2,6-dihydroxy-4-methyl-, octyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 280.167459249 u |
| Formula | C16H24O4 |
| InChI | InChI=1S/C16H24O4/c1-3-4-5-6-7-8-9-20-16(19)15-13(17)10-12(2)11-14(15)18/h10-11,17-18H,3-9H2,1-2H3 |
| InChIKey | SLWOCPXSFQBEFG-UHFFFAOYSA-N |
| SMILES | CCCCCCCCOC(=O)C1=C(O)C=C(C=C1O)C |