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2-Methyl-5-(2-nitrophenyl)thiophene
SpectraBase Compound ID 42pMPKceWxY
InChI InChI=1S/C11H9NO2S/c1-8-6-7-11(15-8)9-4-2-3-5-10(9)12(13)14/h2-7H,1H3
InChIKey UECSOJDPDOUZPR-UHFFFAOYSA-N
Mol Weight 219.26 g/mol
Molecular Formula C11H9NO2S
Exact Mass 219.0354 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7hIjObsNyOY
Name 2-Methyl-5-(2-nitrophenyl)thiophene
Appearance Brown liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 219.035399706 u
Formula C11H9NO2S
GC Column HP-5MS
InChI InChI=1S/C11H9NO2S/c1-8-6-7-11(15-8)9-4-2-3-5-10(9)12(13)14/h2-7H,1H3
InChIKey UECSOJDPDOUZPR-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 219.258 g/mol
Quality 84
Reported Formula C11H9NO2S
SMILES CC=1SC(=CC1)C1=C(C=CC=C1)[N+](=O)[O-]
SPLASH splash10-00vl-0930000000-6f5b07516348ba64f3a4
Source of Spectrum QE-27-SM4-13a (DOI: 10.1002/chem.202102000)
Thin-Layer Chromatography 0.50 (hexane/EtOAc, 5:1)
Wiley ID 1904100