| SpectraBase Compound ID | BEfc4AUfMVW |
|---|---|
| InChI | InChI=1S/C21H35NO2/c1-3-5-6-7-8-9-10-14-18-22(17-4-2)21(23)24-19-20-15-12-11-13-16-20/h11-13,15-16H,3-10,14,17-19H2,1-2H3 |
| InChIKey | TUUVJCIZIOHRMU-UHFFFAOYSA-N |
| Mol Weight | 333.5 g/mol |
| Molecular Formula | C21H35NO2 |
| Exact Mass | 333.266779 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ll0KbLjbTUi |
|---|---|
| Name | Carbonic acid, monoamide, N-propyl-N-decyl-, benzyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 333.266779369 u |
| Formula | C21H35NO2 |
| InChI | InChI=1S/C21H35NO2/c1-3-5-6-7-8-9-10-14-18-22(17-4-2)21(23)24-19-20-15-12-11-13-16-20/h11-13,15-16H,3-10,14,17-19H2,1-2H3 |
| InChIKey | TUUVJCIZIOHRMU-UHFFFAOYSA-N |
| Molecular Weight | 333.516 g/mol |
| SMILES | C(N(CCC)CCCCCCCCCC)(=O)OCC=1C=CC=CC1 |