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3-Trifluoromethylbenzylamine, N-ethyl-N-(3-methylphenyl)-
SpectraBase Compound ID 9UnkBpc2goq
InChI InChI=1S/C17H18F3N/c1-3-21(16-9-4-6-13(2)10-16)12-14-7-5-8-15(11-14)17(18,19)20/h4-11H,3,12H2,1-2H3
InChIKey RGHKHIBPEOTZRP-UHFFFAOYSA-N
Mol Weight 293.33 g/mol
Molecular Formula C17H18F3N
Exact Mass 293.139134 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IzO8ymiJbEo
Name 3-Trifluoromethylbenzylamine, N-ethyl-N-(3-methylphenyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 293.139134073 u
Formula C17H18F3N
InChI InChI=1S/C17H18F3N/c1-3-21(16-9-4-6-13(2)10-16)12-14-7-5-8-15(11-14)17(18,19)20/h4-11H,3,12H2,1-2H3
InChIKey RGHKHIBPEOTZRP-UHFFFAOYSA-N
Molecular Weight 293.333 g/mol
SMILES C(C1=CC(CN(CC)C2=CC(=CC=C2)C)=CC=C1)(F)(F)F