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5-(4-bromophenyl)-4-(1H-imidazol-1-yl)-3-(methylthio)isoxazole
SpectraBase Compound ID LT7mpRUcbOv
InChI InChI=1S/C13H10BrN3OS/c1-19-13-11(17-7-6-15-8-17)12(18-16-13)9-2-4-10(14)5-3-9/h2-8H,1H3
InChIKey DOGRTGGFCUCXRB-UHFFFAOYSA-N
Mol Weight 336.21 g/mol
Molecular Formula C13H10BrN3OS
Exact Mass 334.972796 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F55tEMKC2AP
Name 5-(4-bromophenyl)-4-(1H-imidazol-1-yl)-3-(methylthio)isoxazole
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Formula C13H10BrN3OS
InChI InChI=1S/C13H10BrN3OS/c1-19-13-11(17-7-6-15-8-17)12(18-16-13)9-2-4-10(14)5-3-9/h2-8H,1H3
InChIKey DOGRTGGFCUCXRB-UHFFFAOYSA-N
Literature Reference DOI 10.1002_(SICI)1098-1071(1998)9_3_317
Molecular Weight 336.207 g/mol
SMILES c1(noc(c1-[n]1cncc1)-c1ccc(cc1)Br)SC
SPLASH splash10-0h00-4692000000-75f69d87c69393da7fcf
Source of Spectrum HAC-9-319-4c
Wiley ID 1783173