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2-[2-(4-Chlorophenyl)ethynyl]aniline
SpectraBase Compound ID CRtC3uEwKfV
InChI InChI=1S/C14H10ClN/c15-13-9-6-11(7-10-13)5-8-12-3-1-2-4-14(12)16/h1-4,6-7,9-10H,16H2
InChIKey WMODDNMUXZNAEH-UHFFFAOYSA-N
Mol Weight 227.69 g/mol
Molecular Formula C14H10ClN
Exact Mass 227.050177 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AEb52n4x2Ys
Name 2-[2-(4-Chlorophenyl)ethynyl]aniline
Comments Less than 3 mono-isotopic peaks
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Formula C14H10ClN
InChI InChI=1S/C14H10ClN/c15-13-9-6-11(7-10-13)5-8-12-3-1-2-4-14(12)16/h1-4,6-7,9-10H,16H2
InChIKey WMODDNMUXZNAEH-UHFFFAOYSA-N
Molecular Weight 227.694 g/mol
SMILES Nc1c(cccc1)C#Cc1ccc(cc1)Cl
SPLASH splash10-004i-0090000000-2321b32348baf3c84b41
Source of Spectrum C5-2004-615-1
Synonyms [2-[2-(4-Chlorophenyl)ethynyl]phenyl]amine
Wiley ID 1616739