| SpectraBase Compound ID | 3uN8neM7E7S |
|---|---|
| InChI | InChI=1S/C22H36FNO/c1-4-6-7-8-9-10-11-12-15-18-24(19(3)5-2)22(25)20-16-13-14-17-21(20)23/h13-14,16-17,19H,4-12,15,18H2,1-3H3 |
| InChIKey | DNWXOIBNHRBIKD-UHFFFAOYSA-N |
| Mol Weight | 349.5 g/mol |
| Molecular Formula | C22H36FNO |
| Exact Mass | 349.278093 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5mj54KYihsM |
|---|---|
| Name | Benzamide, 2-fluoro-N-(2-butyl)-N-undecyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 349.278092945 u |
| Formula | C22H36FNO |
| InChI | InChI=1S/C22H36FNO/c1-4-6-7-8-9-10-11-12-15-18-24(19(3)5-2)22(25)20-16-13-14-17-21(20)23/h13-14,16-17,19H,4-12,15,18H2,1-3H3 |
| InChIKey | DNWXOIBNHRBIKD-UHFFFAOYSA-N |
| Molecular Weight | 349.534 g/mol |
| SMILES | C(=O)(N(CCCCCCCCCCC)C(CC)C)C=1C(F)=CC=CC1 |