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2-phenethyl-5-(trifluoromethyl)pyridine
SpectraBase Compound ID Bseeykp26t9
InChI InChI=1S/C14H12F3N/c15-14(16,17)12-7-9-13(18-10-12)8-6-11-4-2-1-3-5-11/h1-5,7,9-10H,6,8H2
InChIKey MOHFTFSIRCZYMF-UHFFFAOYSA-N
Mol Weight 251.25 g/mol
Molecular Formula C14H12F3N
Exact Mass 251.092184 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 58oEiGgDoTS
Name 2-phenethyl-5-(trifluoromethyl)pyridine
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 251.092183879 u
Formula C14H12F3N
InChI InChI=1S/C14H12F3N/c15-14(16,17)12-7-9-13(18-10-12)8-6-11-4-2-1-3-5-11/h1-5,7,9-10H,6,8H2
InChIKey MOHFTFSIRCZYMF-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.201605139
Molecular Weight 251.252 g/mol
Quality 98
Reported Formula C14H12F3N
SMILES C=1(CCC=2C=CC(C(F)(F)F)=CN2)C=CC=CC1
SPLASH splash10-0udi-3190000000-87ae5baaf6516b382aac
Source of Spectrum QE-23-SM34-10c (DOI: 10.1002/chem.201605139)
Thin-Layer Chromatography 0.33 (SiO2, i-hexane/EtOAc, 19:1)
Wiley ID 1903798