For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
4-(5-bromanyl-2-chloranyl-phenyl)carbonyl-5-(4-fluorophenyl)-7-methyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one
SpectraBase Compound ID 2zjQOuY1Eui
InChI InChI=1S/C23H17BrClFN2O2/c1-13-2-9-20-18(10-13)22(14-3-6-16(26)7-4-14)28(12-21(29)27-20)23(30)17-11-15(24)5-8-19(17)25/h2-11,22H,12H2,1H3,(H,27,29)
InChIKey OZWSRHAIKHSHQY-UHFFFAOYSA-N
Mol Weight 487.76 g/mol
Molecular Formula C23H17BrClFN2O2
Exact Mass 486.014597 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID DuAFF5IcMBi
Name 4-(5-bromanyl-2-chloranyl-phenyl)carbonyl-5-(4-fluorophenyl)-7-methyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H17BrClFN2O2
InChI InChI=1S/C23H17BrClFN2O2/c1-13-2-9-20-18(10-13)22(14-3-6-16(26)7-4-14)28(12-21(29)27-20)23(30)17-11-15(24)5-8-19(17)25/h2-11,22H,12H2,1H3,(H,27,29)
InChIKey OZWSRHAIKHSHQY-UHFFFAOYSA-N
Molecular Weight 487.756 g/mol
SMILES N1c2c(C(N(CC1=O)C(c1c(ccc(c1)Br)Cl)=O)c1ccc(cc1)F)cc(cc2)C
SPLASH splash10-0uxr-1490000000-408df799d058353c494e
Synonyms 4-(5-bromo-2-chloro-benzoyl)-5-(4-fluorophenyl)-7-methyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one 4-[(5-bromo-2-chlorophenyl)-oxomethyl]-5-(4-fluorophenyl)-7-methyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one
Wiley ID 1444895