| SpectraBase Compound ID | 3Qh4Cw2zEcD |
|---|---|
| InChI | InChI=1S/C21H26FNO/c1-3-4-6-11-17(2)23(16-18-12-7-5-8-13-18)21(24)19-14-9-10-15-20(19)22/h5,7-10,12-15,17H,3-4,6,11,16H2,1-2H3 |
| InChIKey | DYJNBGKELWOQFB-UHFFFAOYSA-N |
| Mol Weight | 327.44 g/mol |
| Molecular Formula | C21H26FNO |
| Exact Mass | 327.199843 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7FzggSxruQT |
|---|---|
| Name | Benzamide, 2-fluoro-N-benzyl-N-(hept-2-yl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 327.199842623 u |
| Formula | C21H26FNO |
| InChI | InChI=1S/C21H26FNO/c1-3-4-6-11-17(2)23(16-18-12-7-5-8-13-18)21(24)19-14-9-10-15-20(19)22/h5,7-10,12-15,17H,3-4,6,11,16H2,1-2H3 |
| InChIKey | DYJNBGKELWOQFB-UHFFFAOYSA-N |
| Molecular Weight | 327.443 g/mol |
| SMILES | C(N(C(CCCCC)C)CC1=CC=CC=C1)(=O)C=1C(F)=CC=CC1 |