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1-(4-Bromophenyl)-8-[4-(4-fluorophenyl)-4-oxobutyl]-1,3,8-triazaspiro[4.5]decan-4-one

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1-(4-Bromophenyl)-8-[4-(4-fluorophenyl)-4-oxobutyl]-1,3,8-triazaspiro[4.5]decan-4-one
SpectraBase Compound ID LoEytxOZLHO
InChI InChI=1S/C23H25BrFN3O2/c24-18-5-9-20(10-6-18)28-16-26-22(30)23(28)11-14-27(15-12-23)13-1-2-21(29)17-3-7-19(25)8-4-17/h3-10H,1-2,11-16H2,(H,26,30)
InChIKey ALHZOZGEQMHCRV-UHFFFAOYSA-N
Mol Weight 474.37 g/mol
Molecular Formula C23H25BrFN3O2
Exact Mass 473.111418 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DE7wMhLwD7g
Name 1-(4-Bromophenyl)-8-[4-(4-fluorophenyl)-4-oxobutyl]-1,3,8-triazaspiro[4.5]decan-4-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 473.111418218 u
Formula C23H25BrFN3O2
InChI InChI=1S/C23H25BrFN3O2/c24-18-5-9-20(10-6-18)28-16-26-22(30)23(28)11-14-27(15-12-23)13-1-2-21(29)17-3-7-19(25)8-4-17/h3-10H,1-2,11-16H2,(H,26,30)
InChIKey ALHZOZGEQMHCRV-UHFFFAOYSA-N
Molecular Weight 474.374 g/mol
SMILES C12(N(CNC2=O)C=2C=CC(=CC2)Br)CCN(CC1)CCCC(C1=CC=C(C=C1)F)=O