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N-(tert-Butyl)-3-ethyl-4-(4-fluorobenzoyl)-2-phenyl-4,5-dihydro-3H-1,4-benzodiazepine-5-carboxamide
SpectraBase Compound ID CiOEs6CBmsi
InChI InChI=1S/C29H30FN3O2/c1-5-24-25(19-11-7-6-8-12-19)31-23-14-10-9-13-22(23)26(27(34)32-29(2,3)4)33(24)28(35)20-15-17-21(30)18-16-20/h6-18,24,26H,5H2,1-4H3,(H,32,34)
InChIKey RIVVTKDVMPQLDJ-UHFFFAOYSA-N
Mol Weight 471.58 g/mol
Molecular Formula C29H30FN3O2
Exact Mass 471.232205 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E3TbSQwLirU
Name N-(tert-Butyl)-3-ethyl-4-(4-fluorobenzoyl)-2-phenyl-4,5-dihydro-3H-1,4-benzodiazepine-5-carboxamide
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Formula C29H30FN3O2
InChI InChI=1S/C29H30FN3O2/c1-5-24-25(19-11-7-6-8-12-19)31-23-14-10-9-13-22(23)26(27(34)32-29(2,3)4)33(24)28(35)20-15-17-21(30)18-16-20/h6-18,24,26H,5H2,1-4H3,(H,32,34)
InChIKey RIVVTKDVMPQLDJ-UHFFFAOYSA-N
Molecular Weight 471.576 g/mol
SMILES N(C(C1N(C(C(=Nc2c1cccc2)c1ccccc1)CC)C(c1ccc(cc1)F)=O)=O)C(C)(C)C
SPLASH splash10-00di-0915000000-48488872104f16639b6c
Source of Spectrum F-69-9059-12e
Synonyms N-(tert-butyl)-3-ethyl-4-(4-fluorobenzoyl)-2-phenyl-4,5-dihydro-3H-benzo[e][1,4]diazepine-5-carboxamide
Wiley ID 1738595