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(1S)-2,2,2-trifluoro-1-(1H-indol-3-yl)-N-[(1R)-1-(1-naphthalenyl)ethyl]ethanamine
SpectraBase Compound ID LO86Y5RhQaP
InChI InChI=1S/C22H19F3N2/c1-14(16-11-6-8-15-7-2-3-9-17(15)16)27-21(22(23,24)25)19-13-26-20-12-5-4-10-18(19)20/h2-14,21,26-27H,1H3/t14-,21+/m1/s1
InChIKey SHUJXNVZRBUZCR-SZNDQCEHSA-N
Mol Weight 368.4 g/mol
Molecular Formula C22H19F3N2
Exact Mass 368.150033 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IeXLjtMtfob
Name (1S)-2,2,2-Trifluoro-1-(1H-indol-3-yl)-N-[(1R)-1-(1-naphthalenyl)ethyl]ethanamine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 368.150033109 u
Formula C22H19F3N2
InChI InChI=1S/C22H19F3N2/c1-14(16-11-6-8-15-7-2-3-9-17(15)16)27-21(22(23,24)25)19-13-26-20-12-5-4-10-18(19)20/h2-14,21,26-27H,1H3/t14-,21+/m1/s1
InChIKey SHUJXNVZRBUZCR-SZNDQCEHSA-N
Molecular Weight 368.403 g/mol
SMILES C1([C@@](C(F)(F)F)(N[C@@](C2=C3C(C=CC=C3)=CC=C2)(C)[H])[H])=CNC2=C1C=CC=C2