| SpectraBase Compound ID | F9Boepw3CuO |
|---|---|
| InChI | InChI=1S/C24H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-24(26)27-22-23-19-17-18-21-25-23/h17-19,21H,2-16,20,22H2,1H3 |
| InChIKey | JLFLPMHXYAANOH-UHFFFAOYSA-N |
| Mol Weight | 375.6 g/mol |
| Molecular Formula | C24H41NO2 |
| Exact Mass | 375.31373 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EIkaeUB2aPH |
|---|---|
| Name | Octadecanoic acid, 2-pyridinylmethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 375.313729562 u |
| Formula | C24H41NO2 |
| InChI | InChI=1S/C24H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-24(26)27-22-23-19-17-18-21-25-23/h17-19,21H,2-16,20,22H2,1H3 |
| InChIKey | JLFLPMHXYAANOH-UHFFFAOYSA-N |
| Molecular Weight | 375.597 g/mol |
| SMILES | C(=O)(OCC1=NC=CC=C1)CCCCCCCCCCCCCCCCC |