| SpectraBase Compound ID | DKpQ0dIUfGt |
|---|---|
| InChI | InChI=1S/C22H45NO2/c1-6-10-12-13-14-15-18-23(20(5)16-8-3)22(24)25-19-21(9-4)17-11-7-2/h20-21H,6-19H2,1-5H3 |
| InChIKey | APPFEMJMFVRUSE-UHFFFAOYSA-N |
| Mol Weight | 355.6 g/mol |
| Molecular Formula | C22H45NO2 |
| Exact Mass | 355.34503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9Tj4FVS2vlr |
|---|---|
| Name | Carbonic acid, monoamide, N-(2-pentyl)-N-octyl-, 2-ethylhexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 355.345029691 u |
| Formula | C22H45NO2 |
| InChI | InChI=1S/C22H45NO2/c1-6-10-12-13-14-15-18-23(20(5)16-8-3)22(24)25-19-21(9-4)17-11-7-2/h20-21H,6-19H2,1-5H3 |
| InChIKey | APPFEMJMFVRUSE-UHFFFAOYSA-N |
| Molecular Weight | 355.607 g/mol |
| SMILES | CCCC(C)N(C(OCC(CCCC)CC)=O)CCCCCCCC |