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(R, E)-N-(2-benzylidene-1-(3-chlorophenyl)-4-phenylbut-3-ynyl)acetamide
SpectraBase Compound ID 2KOnsa9vMaa
InChI InChI=1S/C25H20ClNO/c1-19(28)27-25(22-13-8-14-24(26)18-22)23(17-21-11-6-3-7-12-21)16-15-20-9-4-2-5-10-20/h2-14,17-18,25H,1H3,(H,27,28)/b23-17+/t25-/m1/s1
InChIKey QMYBKJLOYIWVPQ-LBKCIFGTSA-N
Mol Weight 385.89 g/mol
Molecular Formula C25H20ClNO
Exact Mass 385.123342 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FmxkdSz8Yuo
Name (R, E)-N-(2-benzylidene-1-(3-chlorophenyl)-4-phenylbut-3-ynyl)acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H20ClNO
InChI InChI=1S/C25H20ClNO/c1-19(28)27-25(22-13-8-14-24(26)18-22)23(17-21-11-6-3-7-12-21)16-15-20-9-4-2-5-10-20/h2-14,17-18,25H,1H3,(H,27,28)/b23-17+/t25-/m1/s1
InChIKey QMYBKJLOYIWVPQ-LBKCIFGTSA-N
Literature Reference DOI 10.1002/adsc.200800642
Molecular Weight 385.894 g/mol
SMILES N(C(C)=O)[C@@](\C(C#Cc1ccccc1)=C\c1ccccc1)(c1cc(ccc1)Cl)[H]
SPLASH splash10-0006-9421000000-272a9be360d5fcf14a02
Source of Spectrum ASC-351-357/SM17-6f
Synonyms (R,E)-N-(2-benzylidene-1-(3-chlorophenyl)-4-phenylbut-3-yn-1-yl)acetamide
Wiley ID 1766444