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3-(2-Thienyl)-5-(4-nitrophenyl)-4-(imidazol-2-yl)isoxazole
SpectraBase Compound ID 7zzNX7TIcd8
InChI InChI=1S/C16H12N4O3S/c21-20(22)11-5-3-10(4-6-11)15-13(16-17-7-8-18-16)14(19-23-15)12-2-1-9-24-12/h1-6,9H,7-8H2,(H,17,18)
InChIKey BTFRRGLMBFOGAB-UHFFFAOYSA-N
Mol Weight 340.36 g/mol
Molecular Formula C16H12N4O3S
Exact Mass 340.063011 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FOKB1uLMWQL
Name 3-(2-Thienyl)-5-(4-nitrophenyl)-4-(imidazol-2-yl)isoxazole
Alternate Name(s) 3-(2-Thienyl)-5-(4-nitrophenyl)-4-(4,5-dihydro-imidazol-2-yl)isoxazole
Comments Less than 3 mono-isotopic peaks
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Formula C16H12N4O3S
InChI InChI=1S/C16H12N4O3S/c21-20(22)11-5-3-10(4-6-11)15-13(16-17-7-8-18-16)14(19-23-15)12-2-1-9-24-12/h1-6,9H,7-8H2,(H,17,18)
InChIKey BTFRRGLMBFOGAB-UHFFFAOYSA-N
Molecular Weight 340.357 g/mol
SMILES N1CCN=C1c1c(noc1-c1ccc(N(=O)=O)cc1)-c1sccc1
SPLASH splash10-000l-0019000000-bc5418c319ae5ec31468
Source of Spectrum CV-0-332-6
Wiley ID 849034