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(+/-)-4-FLUORO-8-NITRO-2,3,4,5-TETRAHYDRO-1H-2-BENZAZEPIN-1-ONE
SpectraBase Compound ID EOIYQIwM39T
InChI InChI=1S/C10H9FN2O3/c11-7-3-6-1-2-8(13(15)16)4-9(6)10(14)12-5-7/h1-2,4,7H,3,5H2,(H,12,14)
InChIKey XNVHVJPOVHWWNW-UHFFFAOYSA-N
Mol Weight 224.19 g/mol
Molecular Formula C10H9FN2O3
Exact Mass 224.05972 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6wnyfBnwFM2
Name (+/-)-4-FLUORO-8-NITRO-2,3,4,5-TETRAHYDRO-1H-2-BENZAZEPIN-1-ONE
Compound Number 24
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H9FN2O3
InChI InChI=1S/C10H9FN2O3/c11-7-3-6-1-2-8(13(15)16)4-9(6)10(14)12-5-7/h1-2,4,7H,3,5H2,(H,12,14)
InChIKey XNVHVJPOVHWWNW-UHFFFAOYSA-N
Literature Reference Author G.L.GRUNEWALD,T.M.CALDWELL,Q.LI,K.R.CRISCIONE
Literature Reference Citation J.MED.CHEM.,44,2849(2001)
Literature Reference DOI 10.1021/jm010147g
Molecular Weight 224.191 g/mol
Sample ID 45057
Solvent DMSO-D6