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4-Chloro-2-(phenylethynyl)aniline

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4-Chloro-2-(phenylethynyl)aniline
SpectraBase Compound ID 67yagaG7vlB
InChI InChI=1S/C14H10ClN/c15-13-8-9-14(16)12(10-13)7-6-11-4-2-1-3-5-11/h1-5,8-10H,16H2
InChIKey JUMNQMVRAKHPJD-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 LqXRgfjoyz6
Name 4-Chloro-2-(phenylethynyl)aniline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H10ClN
InChI InChI=1S/C14H10ClN/c15-13-8-9-14(16)12(10-13)7-6-11-4-2-1-3-5-11/h1-5,8-10H,16H2
InChIKey JUMNQMVRAKHPJD-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201000642
Molecular Weight 227.694 g/mol
SMILES Nc1c(cc(cc1)Cl)C#Cc1ccccc1
SPLASH splash10-004i-2690000000-bda6e71371e48974fa58
Source of Spectrum ASC-352-3355/SM5-1f
Synonyms 4-Chloro-2-(2-phenylethynyl)aniline 4-Chloro-2-phenylethynylaniline 4-Chloranyl-2-(2-phenylethynyl)aniline
Wiley ID 1764182