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1H-dibenzo[b,e][1,4]diazepin-1-one, 2,3,4,5,10,11-hexahydro-3,3,7,8-tetramethyl-11-[4-(trifluoromethoxy)phenyl]-
SpectraBase Compound ID BpTPFqWNfIY
InChI InChI=1S/C24H25F3N2O2/c1-13-9-17-18(10-14(13)2)29-22(15-5-7-16(8-6-15)31-24(25,26)27)21-19(28-17)11-23(3,4)12-20(21)30/h5-10,22,28-29H,11-12H2,1-4H3
InChIKey WWIXZOWECVWWJU-UHFFFAOYSA-N
Mol Weight 430.47 g/mol
Molecular Formula C24H25F3N2O2
Exact Mass 430.186813 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GJmyQxATIWb
Name 2,3,9,9-tetramethyl-6-[4-(trifluoromethoxy)phenyl]-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one
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Formula C24H25F3N2O2
InChI InChI=1S/C24H25F3N2O2/c1-13-9-17-18(10-14(13)2)29-22(15-5-7-16(8-6-15)31-24(25,26)27)21-19(28-17)11-23(3,4)12-20(21)30/h5-10,22,28-29H,11-12H2,1-4H3
InChIKey WWIXZOWECVWWJU-UHFFFAOYSA-N
Molecular Weight 430.471 g/mol
SMILES N1c2cc(c(cc2NC(C2=C1CC(CC2=O)(C)C)c1ccc(OC(F)(F)F)cc1)C)C
SPLASH splash10-014i-5791100000-3c17167a0e8e6c79311a
Synonyms 2,3,9,9-tetramethyl-6-[4-(trifluoromethyloxy)phenyl]-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one 3,3,7,8-Tetramethyl-11-[4-(trifluoromethoxy)phenyl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Wiley ID 1448211