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3-(4-(Trifluormethyl)phenyl)tetrahydrofuran
SpectraBase Compound ID LVLGl6OAee4
InChI InChI=1S/C11H11F3O/c12-11(13,14)10-3-1-8(2-4-10)9-5-6-15-7-9/h1-4,9H,5-7H2
InChIKey OHQDQYWXIPHDLJ-UHFFFAOYSA-N
Mol Weight 216.2 g/mol
Molecular Formula C11H11F3O
Exact Mass 216.076199 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6mRcAZZsJS
Name 3-(4-(Trifluormethyl)phenyl)tetrahydrofuran
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 216.076199462 u
Formula C11H11F3O
GC Column Macherey-Nagel OPTIMA1 or Macherey-Nagel OPTIMA5 (25 m x 0.2 mm or 30 m x 0.25 mm, film thickness 0.35 micrometer or 0.25 micrometer)
InChI InChI=1S/C11H11F3O/c12-11(13,14)10-3-1-8(2-4-10)9-5-6-15-7-9/h1-4,9H,5-7H2
InChIKey OHQDQYWXIPHDLJ-UHFFFAOYSA-N
Instrument Name 5925 series II or HP6890-HP5970A
Ionization Type EI
Literature Reference DOI 10.1002/chem.201404903
Molecular Weight 216.203 g/mol
Optical Rotation [a]D20 = -9.2 (c = 1.18, CH2Cl2)
Quality 167
SMILES C1(=CC=C(C=C1)C(F)(F)F)C1COCC1
SPLASH splash10-014i-0900000000-5033adeb1880947bf7f7
Sample Comments >97% ee
Source of Spectrum QE-21-SM40-42 (DOI: 10.1002/chem.201404903)
Thin-Layer Chromatography 0.37 (SiO2, cyclohexane/EtOAc, 2:1)
Wiley ID 1906990