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(2E)-3-(4-tert-butylphenyl)-N-(5-chloro-2-methoxyphenyl)-2-propenamide
SpectraBase Compound ID Iv639tNlpIa
InChI InChI=1S/C20H22ClNO2/c1-20(2,3)15-8-5-14(6-9-15)7-12-19(23)22-17-13-16(21)10-11-18(17)24-4/h5-13H,1-4H3,(H,22,23)/b12-7+
InChIKey FMYKTQVSKVFIJH-KPKJPENVSA-N
Mol Weight 343.85 g/mol
Molecular Formula C20H22ClNO2
Exact Mass 343.133907 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BlQ6IrP0mkH
Name (2E)-3-(4-Tert-butylphenyl)-N-(5-chloro-2-methoxyphenyl)-2-propenamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 343.133906650 u
Formula C20H22ClNO2
InChI InChI=1S/C20H22ClNO2/c1-20(2,3)15-8-5-14(6-9-15)7-12-19(23)22-17-13-16(21)10-11-18(17)24-4/h5-13H,1-4H3,(H,22,23)/b12-7+
InChIKey FMYKTQVSKVFIJH-KPKJPENVSA-N
Molecular Weight 343.854 g/mol
SMILES N(C=1C=C(Cl)C=CC1OC)C(\C=C\C=1C=CC(C(C)(C)C)=CC1)=O