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(2E)-N-[2-(3-chlorophenyl)ethyl]-3-(4-fluorophenyl)-2-propenamide
SpectraBase Compound ID 3mFWsKOHAHi
InChI InChI=1S/C17H15ClFNO/c18-15-3-1-2-14(12-15)10-11-20-17(21)9-6-13-4-7-16(19)8-5-13/h1-9,12H,10-11H2,(H,20,21)/b9-6+
InChIKey CXDKKLDUQPBNES-RMKNXTFCSA-N
Mol Weight 303.76 g/mol
Molecular Formula C17H15ClFNO
Exact Mass 303.08262 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8WQCrtFain1
Name (2E)-N-[2-(3-Chlorophenyl)ethyl]-3-(4-fluorophenyl)-2-propenamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 303.082619969 u
Formula C17H15ClFNO
InChI InChI=1S/C17H15ClFNO/c18-15-3-1-2-14(12-15)10-11-20-17(21)9-6-13-4-7-16(19)8-5-13/h1-9,12H,10-11H2,(H,20,21)/b9-6+
InChIKey CXDKKLDUQPBNES-RMKNXTFCSA-N
Molecular Weight 303.764 g/mol
SMILES N(CCC=1C=C(Cl)C=CC1)C(\C=C\C1=CC=C(F)C=C1)=O