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(4-Nitrophenyl)(phenyl)ethyne
SpectraBase Compound ID 9gHxtcUuwia
InChI InChI=1S/C14H9NO2/c16-15(17)14-10-8-13(9-11-14)7-6-12-4-2-1-3-5-12/h1-5,8-11H
InChIKey JWCIMYGAABSRQD-UHFFFAOYSA-N
Mol Weight 223.23 g/mol
Molecular Formula C14H9NO2
Exact Mass 223.063329 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Il47oviFKKb
Name 1-nitro-4-(phenylethynyl)benzene
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H9NO2
InChI InChI=1S/C14H9NO2/c16-15(17)14-10-8-13(9-11-14)7-6-12-4-2-1-3-5-12/h1-5,8-11H
InChIKey JWCIMYGAABSRQD-UHFFFAOYSA-N
Instrument Name Agilent Technologies 5973N
Ionization Type EI
Literature Reference DOI 10.1002/adsc.201900472
Molecular Weight 223.231 g/mol
SMILES c1ccccc1C#Cc1ccc(cc1)[N+](=O)[O-]
SPLASH splash10-00fr-0970000000-10a40c92eab46f6d023d
Source of Spectrum ASC-361-SM12-13b
Thin-Layer Chromatography Rf = 0.43 (Hexane/AcOEt, 98:2)
Wiley ID 1835306