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(S, E)-N-(2-benzylidene-1-(2-chlorophenyl)-4-phenylbut-3-ynyl)acetamide
SpectraBase Compound ID ANq1JYEr5RU
InChI InChI=1S/C25H20ClNO/c1-19(28)27-25(23-14-8-9-15-24(23)26)22(18-21-12-6-3-7-13-21)17-16-20-10-4-2-5-11-20/h2-15,18,25H,1H3,(H,27,28)/b22-18+/t25-/m0/s1
InChIKey BDJZTDAMSQJRHX-CBPAOYKXSA-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 9zvtC0STK6l
Name (S, E)-N-(2-benzylidene-1-(2-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(23-14-8-9-15-24(23)26)22(18-21-12-6-3-7-13-21)17-16-20-10-4-2-5-11-20/h2-15,18,25H,1H3,(H,27,28)/b22-18+/t25-/m0/s1
InChIKey BDJZTDAMSQJRHX-CBPAOYKXSA-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)(c1c(cccc1)Cl)[H]
SPLASH splash10-0006-9521000000-ac27e3d3ae3d186d28fd
Source of Spectrum ASC-351-357/SM16-6e
Synonyms (S,E)-N-(2-benzylidene-1-(2-chlorophenyl)-4-phenylbut-3-yn-1-yl)acetamide
Wiley ID 1766443