| SpectraBase Compound ID | klZtONnFHm |
|---|---|
| InChI | InChI=1S/C24H40O3/c1-4-6-7-8-9-10-11-12-13-14-16-23(15-5-2)27-24(25)21-17-19-22(26-3)20-18-21/h17-20,23H,4-16H2,1-3H3 |
| InChIKey | ZSQPHXQMQBANPM-UHFFFAOYSA-N |
| Mol Weight | 376.6 g/mol |
| Molecular Formula | C24H40O3 |
| Exact Mass | 376.297745 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 69ODtW1Qy5W |
|---|---|
| Name | p-Anisic acid, 4-hexadecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 376.297745145 u |
| Formula | C24H40O3 |
| InChI | InChI=1S/C24H40O3/c1-4-6-7-8-9-10-11-12-13-14-16-23(15-5-2)27-24(25)21-17-19-22(26-3)20-18-21/h17-20,23H,4-16H2,1-3H3 |
| InChIKey | ZSQPHXQMQBANPM-UHFFFAOYSA-N |
| Molecular Weight | 376.581 g/mol |
| SMILES | C(OC(CCCCCCCCCCCC)CCC)(=O)C1=CC=C(OC)C=C1 |