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 |