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2-(4-(Trifluoromethyl)phenyl)-1,2,3,4-tetrahydroisoquinoline
SpectraBase Compound ID Ap5nmaSaAAS
InChI InChI=1S/C16H14F3N/c17-16(18,19)14-5-7-15(8-6-14)20-10-9-12-3-1-2-4-13(12)11-20/h1-8H,9-11H2
InChIKey ZLHKWIRYBGFXCN-UHFFFAOYSA-N
Mol Weight 277.29 g/mol
Molecular Formula C16H14F3N
Exact Mass 277.107834 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fpx5HcnlplM
Name 2-(4-(Trifluoromethyl)phenyl)-1,2,3,4-tetrahydroisoquinoline
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 277.107833944 u
Formula C16H14F3N
GC Column Varian (25 m x 0.25 mm, film thickness 0.25 micrometer)
InChI InChI=1S/C16H14F3N/c17-16(18,19)14-5-7-15(8-6-14)20-10-9-12-3-1-2-4-13(12)11-20/h1-8H,9-11H2
InChIKey ZLHKWIRYBGFXCN-UHFFFAOYSA-N
Instrument Name Thermo Scientific ITQ 700 GCMS
Ionization Type EI positive ion
Literature Reference DOI 10.1021/acs.joc.2c01964
Molecular Weight 277.290 g/mol
Quality 206
SMILES C(C1=CC=C(C=C1)N1CC2=C(CC1)C=CC=C2)(F)(F)F
SPLASH splash10-004i-0190000000-58ce1b092f4c36cf09fa
Source of Spectrum JOC-88-680-4e (DOI: 10.1021/acs.joc.2c01964)
Wiley ID 1912600