| SpectraBase Compound ID | LluRbwiDOUN |
|---|---|
| InChI | InChI=1S/C22H36FNO/c1-3-5-7-9-11-15-19-24(18-14-10-8-6-4-2)22(25)20-16-12-13-17-21(20)23/h12-13,16-17H,3-11,14-15,18-19H2,1-2H3 |
| InChIKey | CBZQOWVJKDMNLP-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 | 5CfLJMWhWp6 |
|---|---|
| Name | Benzamide, N-heptyl-N-octyl-2-fluoro- |
| 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/c1-3-5-7-9-11-15-19-24(18-14-10-8-6-4-2)22(25)20-16-12-13-17-21(20)23/h12-13,16-17H,3-11,14-15,18-19H2,1-2H3 |
| InChIKey | CBZQOWVJKDMNLP-UHFFFAOYSA-N |
| Molecular Weight | 349.534 g/mol |
| SMILES | C1=CC=C(C(=C1)C(N(CCCCCCC)CCCCCCCC)=O)F |