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1-Nitro-3-(phenylethynyl)benzene

View entire compound with spectra: 1 FTIR, and 4 MS (GC)

1-Nitro-3-(phenylethynyl)benzene
SpectraBase Compound ID 9VWOXuQdROh
InChI InChI=1S/C14H9NO2/c16-15(17)14-8-4-7-13(11-14)10-9-12-5-2-1-3-6-12/h1-8,11H
InChIKey WIDIJEWZZQPARQ-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 66O303UTHjs
Name 1-Nitro-3-(phenylethynyl)benzene
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H9NO2
InChI InChI=1S/C14H9NO2/c16-15(17)14-8-4-7-13(11-14)10-9-12-5-2-1-3-6-12/h1-8,11H
InChIKey WIDIJEWZZQPARQ-UHFFFAOYSA-N
Literature Reference DOI 10.1039/C5CC06347G
Molecular Weight 223.231 g/mol
SMILES c1(cc(ccc1)C#Cc1ccccc1)[N+](=O)[O-]
SPLASH splash10-00fr-0970000000-0deb19f855375c448834
Source of Spectrum KD-51-15522/SM6-3f
Wiley ID 1800955