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2,3-Dimethoxy-2'-nitro-1,1'-biphenyl
SpectraBase Compound ID 9gxNQBmJ6mU
InChI InChI=1S/C14H13NO4/c1-18-13-9-5-7-11(14(13)19-2)10-6-3-4-8-12(10)15(16)17/h3-9H,1-2H3
InChIKey RTFTXWRLFCDJRW-UHFFFAOYSA-N
Mol Weight 259.26 g/mol
Molecular Formula C14H13NO4
Exact Mass 259.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7m33FmrHrfj
Name 2,3-Dimethoxy-2'-nitro-1,1'-biphenyl
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 259.084457899 u
Formula C14H13NO4
GC Column HP-5MS
InChI InChI=1S/C14H13NO4/c1-18-13-9-5-7-11(14(13)19-2)10-6-3-4-8-12(10)15(16)17/h3-9H,1-2H3
InChIKey RTFTXWRLFCDJRW-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 259.261 g/mol
Quality 55
SMILES COC=1C(=C(C=CC1)C1=C(C=CC=C1)[N+](=O)[O-])OC
SPLASH splash10-0a4i-0490000000-46d28bba540cfad37932
Source of Spectrum QE-27-SM7-19f (DOI: 10.1002/chem.202102000)
Thin-Layer Chromatography 0.28 (hexane/EtOAc, 5:1)
Wiley ID 1904110