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11-(5-Bromo-2-fluorophenyl)-3,3,7,8-tetramethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
SpectraBase Compound ID 7uYMBvsaM5D
InChI InChI=1S/C23H24BrFN2O/c1-12-7-17-18(8-13(12)2)27-22(15-9-14(24)5-6-16(15)25)21-19(26-17)10-23(3,4)11-20(21)28/h5-9,22,26-27H,10-11H2,1-4H3
InChIKey WGXUZVDOIBYSGG-UHFFFAOYSA-N
Mol Weight 443.36 g/mol
Molecular Formula C23H24BrFN2O
Exact Mass 442.105605 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BuWZqja76gS
Name 11-(5-Bromo-2-fluorophenyl)-3,3,7,8-tetramethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Alternate Name(s) 6-(5-bromanyl-2-fluoranyl-phenyl)-2,3,9,9-tetramethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one 6-(5-bromo-2-fluoro-phenyl)-2,3,9,9-tetramethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one
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Formula C23H24BrFN2O
InChI InChI=1S/C23H24BrFN2O/c1-12-7-17-18(8-13(12)2)27-22(15-9-14(24)5-6-16(15)25)21-19(26-17)10-23(3,4)11-20(21)28/h5-9,22,26-27H,10-11H2,1-4H3
InChIKey WGXUZVDOIBYSGG-UHFFFAOYSA-N
Molecular Weight 443.360 g/mol
SMILES N1c2cc(c(cc2NC2=C(C1c1c(ccc(c1)Br)F)C(CC(C)(C)C2)=O)C)C
SPLASH splash10-014i-3690100000-e090f844ad912097e30b
Wiley ID 1454816