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2-[2-(4-bromophenylethynyl)phenoxy]aniline
SpectraBase Compound ID FAOrWkZIScL
InChI InChI=1S/C20H14BrNO/c21-17-13-10-15(11-14-17)9-12-16-5-1-3-7-19(16)23-20-8-4-2-6-18(20)22/h1-8,10-11,13-14H,22H2
InChIKey SBIJWQCRQVYNAI-UHFFFAOYSA-N
Mol Weight 364.24 g/mol
Molecular Formula C20H14BrNO
Exact Mass 363.025877 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ApI2thvVIKA
Name 2-[2-(4-bromophenylethynyl)phenoxy]aniline
Appearance Yellow solid
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Exact Mass 363.025877074 u
Formula C20H14BrNO
InChI InChI=1S/C20H14BrNO/c21-17-13-10-15(11-14-17)9-12-16-5-1-3-7-19(16)23-20-8-4-2-6-18(20)22/h1-8,10-11,13-14H,22H2
InChIKey SBIJWQCRQVYNAI-UHFFFAOYSA-N
Instrument Name Shimadzu QP-2010 GC-MS
Ionization Type EI
Literature Reference DOI 10.1002/chem.201504443
Molecular Weight 364.242 g/mol
Quality 299
SMILES NC1=C(OC2=C(C#CC3=CC=C(Br)C=C3)C=CC=C2)C=CC=C1
SPLASH splash10-001i-0958000000-4c5c9c7a22bdcf8914b1
Source of Spectrum QE-22-3060-1b (DOI: 10.1002/chem.201504443)
Wiley ID 1905387