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2-Methyl-4'-nitro-1,1'-biphenyl
SpectraBase Compound ID LsiXhvNJnsQ
InChI InChI=1S/C13H11NO2/c1-10-4-2-3-5-13(10)11-6-8-12(9-7-11)14(15)16/h2-9H,1H3
InChIKey CVZLYJUYMKUYCZ-UHFFFAOYSA-N
Mol Weight 213.24 g/mol
Molecular Formula C13H11NO2
Exact Mass 213.078979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2F0mIzMetk
Name 2-Methyl-4'-nitro-1,1'-biphenyl
Appearance Pale yellow solid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 213.078978596 u
Formula C13H11NO2
InChI InChI=1S/C13H11NO2/c1-10-4-2-3-5-13(10)11-6-8-12(9-7-11)14(15)16/h2-9H,1H3
InChIKey CVZLYJUYMKUYCZ-UHFFFAOYSA-N
Instrument Name Agilent Technologies 7820A-5975 series MSD
Ionization Type EI
Literature Reference DOI 10.1002/anie.201808386
Molecular Weight 213.236 g/mol
Quality 296
SMILES CC1=C(C=CC=C1)C1=CC=C(C=C1)[N+](=O)[O-]
SPLASH splash10-0j4i-0950000000-01918e9a5fef0935edf8
Source of Spectrum ACI-57-SM21-58 (DOI: 10.1002/anie.201808386)
Thin-Layer Chromatography 0.45 (5% ethyl acetate/hexane)
Wiley ID 1893447