![2-[[(4-fluorophenyl)amino]methyl]phenol, N,o-bis-acetyl](/api/spectrum/Acv2Xx8ikuY/structure.png?h=300&w=458 "2-[[(4-fluorophenyl)amino]methyl]phenol, N,o-bis-acetyl")
| SpectraBase Compound ID | Ad7hsYQwi59 |
|---|---|
| InChI | InChI=1S/C17H16FNO3/c1-12(20)19(16-9-7-15(18)8-10-16)11-14-5-3-4-6-17(14)22-13(2)21/h3-10H,11H2,1-2H3 |
| InChIKey | BZMVHFXCSXLHCK-UHFFFAOYSA-N |
| Mol Weight | 301.32 g/mol |
| Molecular Formula | C17H16FNO3 |
| Exact Mass | 301.111422 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Acv2Xx8ikuY |
|---|---|
| Name | 2-[[(4-fluorophenyl)amino]methyl]phenol, N,o-bis-acetyl |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 301.111421539 u |
| Formula | C17H16FNO3 |
| InChI | InChI=1S/C17H16FNO3/c1-12(20)19(16-9-7-15(18)8-10-16)11-14-5-3-4-6-17(14)22-13(2)21/h3-10H,11H2,1-2H3 |
| InChIKey | BZMVHFXCSXLHCK-UHFFFAOYSA-N |
| Molecular Weight | 301.317 g/mol |
| SMILES | C1(=C(C=CC=C1)CN(C(C)=O)C=1C=CC(F)=CC1)OC(=O)C |