| SpectraBase Compound ID | CUTVjLmbPDd |
|---|---|
| InChI | InChI=1S/C22H39NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22(24)23-20-17-18-21-23/h5-8H,2-4,9-21H2,1H3/b6-5-,8-7- |
| InChIKey | ZWFKMRBPSWNRBH-ISTTXYCBSA-N |
| Mol Weight | 333.6 g/mol |
| Molecular Formula | C22H39NO |
| Exact Mass | 333.303165 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Cdtd8ERahYE |
|---|---|
| Name | 10,13-Octadecadienooic acid, pyrrolidide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 333.303164879 u |
| Formula | C22H39NO |
| InChI | InChI=1S/C22H39NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22(24)23-20-17-18-21-23/h5-8H,2-4,9-21H2,1H3/b6-5-,8-7- |
| InChIKey | ZWFKMRBPSWNRBH-ISTTXYCBSA-N |
| Molecular Weight | 333.560 g/mol |
| SMILES | C(N1CCCC1)(CCCCCCCCC\C=C/C=C\CCCC)=O |