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11-(3-bromo-4,5-dimethoxyphenyl)-3,3,7,8-tetramethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
SpectraBase Compound ID 7eZdygaqW7z
InChI InChI=1S/C25H29BrN2O3/c1-13-7-17-18(8-14(13)2)28-23(15-9-16(26)24(31-6)21(10-15)30-5)22-19(27-17)11-25(3,4)12-20(22)29/h7-10,23,27-28H,11-12H2,1-6H3
InChIKey JFBHWCRZTNUMTM-UHFFFAOYSA-N
Mol Weight 485.42 g/mol
Molecular Formula C25H29BrN2O3
Exact Mass 484.136156 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2G2b7aJpNUL
Name 11-(3-Bromo-4,5-dimethoxyphenyl)-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-(3-bromanyl-4,5-dimethoxy-phenyl)-2,3,9,9-tetramethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one 6-(3-bromo-4,5-dimethoxy-phenyl)-2,3,9,9-tetramethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one
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Formula C25H29BrN2O3
InChI InChI=1S/C25H29BrN2O3/c1-13-7-17-18(8-14(13)2)28-23(15-9-16(26)24(31-6)21(10-15)30-5)22-19(27-17)11-25(3,4)12-20(22)29/h7-10,23,27-28H,11-12H2,1-6H3
InChIKey JFBHWCRZTNUMTM-UHFFFAOYSA-N
Molecular Weight 485.422 g/mol
SMILES N1c2cc(c(cc2NC2=C(C1c1cc(Br)c(c(c1)OC)OC)C(CC(C)(C)C2)=O)C)C
SPLASH splash10-014i-4490400000-198465809e852712b356
Wiley ID 1454559