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3'-Methoxy-2-nitro-1,1'-biphenyl
SpectraBase Compound ID 8jB1DSZ3EoI
InChI InChI=1S/C13H11NO3/c1-17-11-6-4-5-10(9-11)12-7-2-3-8-13(12)14(15)16/h2-9H,1H3
InChIKey FXCKQJIDZUXYTI-UHFFFAOYSA-N
Mol Weight 229.23 g/mol
Molecular Formula C13H11NO3
Exact Mass 229.073893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2lqNoILFXCo
Name 3'-Methoxy-2-nitro-1,1'-biphenyl
Appearance White crystalline solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 229.073893215 u
Formula C13H11NO3
GC Column HP-5MS
InChI InChI=1S/C13H11NO3/c1-17-11-6-4-5-10(9-11)12-7-2-3-8-13(12)14(15)16/h2-9H,1H3
InChIKey FXCKQJIDZUXYTI-UHFFFAOYSA-N
Instrument Name Agilent 6890N-5973 or Thermo Scientific Trace 1300 Series-ISQ Single Quadrupole
Ionization Type EI
Literature Reference DOI 10.1002/chem.202102000
Molecular Weight 229.235 g/mol
Quality 68
SMILES COC=1C=C(C=CC1)C1=C(C=CC=C1)[N+](=O)[O-]
SPLASH splash10-004r-0950000000-b1321c19eeaec714be9f
Source of Spectrum QE-27-SM8-19k (DOI: 10.1002/chem.202102000)
Thin-Layer Chromatography 0.36 (hexane/EtOAc, 4:1)
Wiley ID 1904113