| SpectraBase Compound ID | 13NUpIJES7c |
|---|---|
| InChI | InChI=1S/C23H45NO/c1-5-6-7-11-14-17-21(2)18-15-12-9-8-10-13-16-19-22-24-23(3,4)20-25-22/h21H,5-20H2,1-4H3 |
| InChIKey | ZAYZNMBUSVCMMT-UHFFFAOYSA-N |
| Mol Weight | 351.6 g/mol |
| Molecular Formula | C23H45NO |
| Exact Mass | 351.350115 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3KwY6Cwp9f2 |
|---|---|
| Name | 11-Methyl-octadecanoic acid, dmox derivative |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 351.350115072 u |
| Formula | C23H45NO |
| InChI | InChI=1S/C23H45NO/c1-5-6-7-11-14-17-21(2)18-15-12-9-8-10-13-16-19-22-24-23(3,4)20-25-22/h21H,5-20H2,1-4H3 |
| InChIKey | ZAYZNMBUSVCMMT-UHFFFAOYSA-N |
| Molecular Weight | 351.619 g/mol |
| SMILES | C=1(CCCCCCCCCC(CCCCCCC)C)OCC(N1)(C)C |