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4-FLUORO-2,3,4,5-TETRAHYDRO-1H-2-BENZAZEPINE-HYDROCHLORIDE
SpectraBase Compound ID JKecy5fL3aC
InChI InChI=1S/C10H12FN.ClH/c11-10-5-8-3-1-2-4-9(8)6-12-7-10;/h1-4,10,12H,5-7H2;1H
InChIKey XXKXCHJCSWVXGO-UHFFFAOYSA-N
Mol Weight 201.67 g/mol
Molecular Formula C10H13ClFN
Exact Mass 201.072055 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EQd4EHjzg5d
Name 4-FLUORO-2,3,4,5-TETRAHYDRO-1H-2-BENZAZEPINE-HYDROCHLORIDE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H13ClFN
InChI InChI=1S/C10H12FN.ClH/c11-10-5-8-3-1-2-4-9(8)6-12-7-10;/h1-4,10,12H,5-7H2;1H
InChIKey XXKXCHJCSWVXGO-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 201.671 g/mol
Sample ID 45056
Solvent DMSO-D6