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.alpha.-Acetamido-4-fluoro-4'-methoxycinnamanilide
SpectraBase Compound ID IdBRsfEdExr
InChI InChI=1S/C18H17FN2O3/c1-12(22)20-17(11-13-3-5-14(19)6-4-13)18(23)21-15-7-9-16(24-2)10-8-15/h3-11H,1-2H3,(H,20,22)(H,21,23)/b17-11-
InChIKey VQLHWJVWENMHEV-BOPFTXTBSA-N
Mol Weight 328.34 g/mol
Molecular Formula C18H17FN2O3
Exact Mass 328.122321 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4fU73gTEjad
Name .alpha.-Acetamido-4-fluoro-4'-methoxycinnamanilide
Comments Computed using HOSE algorithm
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Exact Mass 328.122320575 u
Formula C18H17FN2O3
InChI InChI=1S/C18H17FN2O3/c1-12(22)20-17(11-13-3-5-14(19)6-4-13)18(23)21-15-7-9-16(24-2)10-8-15/h3-11H,1-2H3,(H,20,22)(H,21,23)/b17-11-
InChIKey VQLHWJVWENMHEV-BOPFTXTBSA-N
Molecular Weight 328.343 g/mol
SMILES C(\C(NC(C)=O)=C\C1=CC=C(C=C1)F)(NC=1C=CC(OC)=CC1)=O