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Ethanamine, 2-[4-(4-chloro-1,2-diphenyl-1-buten-1-yl)phenoxy]-N,N-dimethyl-
SpectraBase Compound ID CmwfvpbiMF7
InChI InChI=1S/C26H28ClNO/c1-28(2)19-20-29-24-15-13-23(14-16-24)26(22-11-7-4-8-12-22)25(17-18-27)21-9-5-3-6-10-21/h3-16H,17-20H2,1-2H3/b26-25-
InChIKey XFCLJVABOIYOMF-QPLCGJKRSA-N
Mol Weight 405.97 g/mol
Molecular Formula C26H28ClNO
Exact Mass 405.185942 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1UjHGjN1T0q
Name Ethanamine, 2-[4-(4-chloro-1,2-diphenyl-1-buten-1-yl)phenoxy]-N,N-dimethyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 405.185942225 u
Formula C26H28ClNO
InChI InChI=1S/C26H28ClNO/c1-28(2)19-20-29-24-15-13-23(14-16-24)26(22-11-7-4-8-12-22)25(17-18-27)21-9-5-3-6-10-21/h3-16H,17-20H2,1-2H3/b26-25-
InChIKey XFCLJVABOIYOMF-QPLCGJKRSA-N
Molecular Weight 405.969 g/mol
SMILES C(Cl)C\C(=C\(C1=CC=C(C=C1)OCCN(C)C)C1=CC=CC=C1)C1=CC=CC=C1