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5-Bromo-1-phenyl-1,5,6,7-tetrahydro-4H-indazol-4-one
SpectraBase Compound ID BhAT2XFjjB6
InChI InChI=1S/C13H11BrN2O/c14-11-6-7-12-10(13(11)17)8-15-16(12)9-4-2-1-3-5-9/h1-5,8,11H,6-7H2
InChIKey MIYPPKAYULSMQS-UHFFFAOYSA-N
Mol Weight 291.15 g/mol
Molecular Formula C13H11BrN2O
Exact Mass 290.005476 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1iJpSHrl8i
Name 5-Bromo-1-phenyl-1,5,6,7-tetrahydro-4H-indazol-4-one
Alternate Name(s) 5-Bromanyl-1-phenyl-6,7-dihydro-5H-indazol-4-one 5-Bromo-1-phenyl-6,7-dihydro-5H-indazol-4-one Indazol-4-one, 5-bromo-1-phenyl-1,5,6,7-tetrahydro-
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Formula C13H11BrN2O
InChI InChI=1S/C13H11BrN2O/c14-11-6-7-12-10(13(11)17)8-15-16(12)9-4-2-1-3-5-9/h1-5,8,11H,6-7H2
InChIKey MIYPPKAYULSMQS-UHFFFAOYSA-N
Molecular Weight 291.148 g/mol
SMILES c12c([n](-c3ccccc3)nc1)CCC(C2=O)Br
SPLASH splash10-001i-6930000000-b8dcc374f754d349f421
Wiley ID 1439865