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4-(4-bromo-1H-pyrazol-1-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzamide
SpectraBase Compound ID 7oUYCFPXq6x
InChI InChI=1S/C18H14BrN3O3/c19-13-10-20-22(11-13)15-4-1-12(2-5-15)18(23)21-14-3-6-16-17(9-14)25-8-7-24-16/h1-6,9-11H,7-8H2,(H,21,23)
InChIKey ROGDGRGVNNWSJO-UHFFFAOYSA-N
Mol Weight 400.23 g/mol
Molecular Formula C18H14BrN3O3
Exact Mass 399.021854 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E8jHzPnygLf
Name 4-(4-bromo-1H-pyrazol-1-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzamide
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Formula C18H14BrN3O3
InChI InChI=1S/C18H14BrN3O3/c19-13-10-20-22(11-13)15-4-1-12(2-5-15)18(23)21-14-3-6-16-17(9-14)25-8-7-24-16/h1-6,9-11H,7-8H2,(H,21,23)
InChIKey ROGDGRGVNNWSJO-UHFFFAOYSA-N
Molecular Weight 400.232 g/mol
SMILES N(C(c1ccc(cc1)-[n]1cc(Br)cn1)=O)c1cc2c(cc1)OCCO2
SPLASH splash10-0udj-7980000000-5ca18b4fed10a1fc4548
Source of Spectrum IY-2-5213-4
Synonyms 4-(4-bromo-1-pyrazolyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzamide 4-(4-bromanylpyrazol-1-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzamide
Wiley ID 1660117