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4-Acetyl-5-((4-chlorophenyl)ethynyl)-3-methyl-[1,1'-biphenyl]-2-carbonitrile
SpectraBase Compound ID 5pif9I5U4b9
InChI InChI=1S/C24H16ClNO/c1-16-23(15-26)22(19-6-4-3-5-7-19)14-20(24(16)17(2)27)11-8-18-9-12-21(25)13-10-18/h3-7,9-10,12-14H,1-2H3
InChIKey MDPYYOYJROYZRT-UHFFFAOYSA-N
Mol Weight 369.85 g/mol
Molecular Formula C24H16ClNO
Exact Mass 369.092042 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IzWwTJGEILJ
Name 4-Acetyl-5-((4-chlorophenyl)ethynyl)-3-methyl-[1,1'-biphenyl]-2-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H16ClNO
InChI InChI=1S/C24H16ClNO/c1-16-23(15-26)22(19-6-4-3-5-7-19)14-20(24(16)17(2)27)11-8-18-9-12-21(25)13-10-18/h3-7,9-10,12-14H,1-2H3
InChIKey MDPYYOYJROYZRT-UHFFFAOYSA-N
Molecular Weight 369.851 g/mol
SMILES c1(c(c(cc(c1C#N)-c1ccccc1)C#Cc1ccc(cc1)Cl)C(C)=O)C
SPLASH splash10-0gi3-0019000000-266303055ae136003c0b
Source of Spectrum ASC-360-SM23-3la
Wiley ID 1811744