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n-Pentafluorobenzoyl-N-desmethylmethoxyphenamine

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

n-Pentafluorobenzoyl-N-desmethylmethoxyphenamine
SpectraBase Compound ID 9nmgbMq3AK5
InChI InChI=1S/C17H14F5NO2/c1-8(7-9-5-3-4-6-10(9)25-2)23-17(24)11-12(18)14(20)16(22)15(21)13(11)19/h3-6,8H,7H2,1-2H3,(H,23,24)
InChIKey CKYHKEMHLXKWIB-UHFFFAOYSA-N
Mol Weight 359.3 g/mol
Molecular Formula C17H14F5NO2
Exact Mass 359.09447 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ac8GP30y7pu
Name N-Pentafluorobenzoyl-N-desmethylmethoxyphenamine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 359.094469508 u
Formula C17H14F5NO2
InChI InChI=1S/C17H14F5NO2/c1-8(7-9-5-3-4-6-10(9)25-2)23-17(24)11-12(18)14(20)16(22)15(21)13(11)19/h3-6,8H,7H2,1-2H3,(H,23,24)
InChIKey CKYHKEMHLXKWIB-UHFFFAOYSA-N
Molecular Weight 359.296 g/mol
Nominal Mass 359 u
SMILES C1=CC(=C(C=C1)CC(C)NC(=O)C1=C(C(=C(C(=C1F)F)F)F)F)OC