| SpectraBase Compound ID | 5tll9AvWIHf |
|---|---|
| InChI | InChI=1S/C12H16FNO/c1-9(2)7-8-14-12(15)10-3-5-11(13)6-4-10/h3-6,9H,7-8H2,1-2H3,(H,14,15) |
| InChIKey | AEHCDQCYHVRHSL-UHFFFAOYSA-N |
| Mol Weight | 209.26 g/mol |
| Molecular Formula | C12H16FNO |
| Exact Mass | 209.121592 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HO7nBlhrAbh |
|---|---|
| Name | Benzamide, 4-fluoro-N-3-methylbutyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 209.121592301 u |
| Formula | C12H16FNO |
| InChI | InChI=1S/C12H16FNO/c1-9(2)7-8-14-12(15)10-3-5-11(13)6-4-10/h3-6,9H,7-8H2,1-2H3,(H,14,15) |
| InChIKey | AEHCDQCYHVRHSL-UHFFFAOYSA-N |
| Molecular Weight | 209.264 g/mol |
| SMILES | C(NCCC(C)C)(=O)C=1C=CC(=CC1)F |