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(R, E)-N-(2-benzylidene-1,4-diphenylbut-3-ynyl)acetamide
SpectraBase Compound ID 9MuR74ceUTb
InChI InChI=1S/C25H21NO/c1-20(27)26-25(23-15-9-4-10-16-23)24(19-22-13-7-3-8-14-22)18-17-21-11-5-2-6-12-21/h2-16,19,25H,1H3,(H,26,27)/b24-19+/t25-/m1/s1
InChIKey GLYWVYFEDIGRHF-FLXPQLCOSA-N
Mol Weight 351.45 g/mol
Molecular Formula C25H21NO
Exact Mass 351.162314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K1AicPLXT8h
Name (R, E)-N-(2-benzylidene-1,4-diphenylbut-3-ynyl)acetamide
Alternate Name(s) (R,E)-N-(2-benzylidene-1,4-diphenylbut-3-yn-1-yl)acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H21NO
InChI InChI=1S/C25H21NO/c1-20(27)26-25(23-15-9-4-10-16-23)24(19-22-13-7-3-8-14-22)18-17-21-11-5-2-6-12-21/h2-16,19,25H,1H3,(H,26,27)/b24-19+/t25-/m1/s1
InChIKey GLYWVYFEDIGRHF-FLXPQLCOSA-N
Literature Reference DOI 10.1002/adsc.200800642
Molecular Weight 351.449 g/mol
SMILES N(C(C)=O)[C@@](\C(C#Cc1ccccc1)=C\c1ccccc1)(c1ccccc1)[H]
SPLASH splash10-052f-9000000000-d226298cd9fe08e52b62
Source of Spectrum ASC-351-357/SM15-6a
Wiley ID 1766441