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1-(4'-(Trifluoromethyl)benzyl)-1H-indole
SpectraBase Compound ID DDYGFAhaEjD
InChI InChI=1S/C16H12F3N/c17-16(18,19)14-7-5-12(6-8-14)11-20-10-9-13-3-1-2-4-15(13)20/h1-10H,11H2
InChIKey ASDUSQIQATUEKD-UHFFFAOYSA-N
Mol Weight 275.27 g/mol
Molecular Formula C16H12F3N
Exact Mass 275.092184 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 27Nm6F2b8p8
Name 1-(4'-(Trifluoromethyl)benzyl)-1H-indole
Appearance Colorless oil
Carrier Gas Helium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 275.092183879 u
Formula C16H12F3N
GC Column SLBTM-5ms (30 m ?? 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 250oC
InChI InChI=1S/C16H12F3N/c17-16(18,19)14-7-5-12(6-8-14)11-20-10-9-13-3-1-2-4-15(13)20/h1-10H,11H2
InChIKey ASDUSQIQATUEKD-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP2010S
Ionization Type EI
Literature Reference DOI 10.1002/chem.202201809
Molecular Weight 275.274 g/mol
Quality 176
SMILES C1(=CC=C(C=C1)C(F)(F)F)CN1C=CC2=C1C=CC=C2
SPLASH splash10-056r-1980000000-b835791f366c225ae4e1
Source of Spectrum QE-28-SM19-10j (DOI: 10.1002/chem.202201809)
Wiley ID 1900654