Product Name2,2,2-Trifluoroethanol
CAS75-89-8
Molecular FormulaC2H3F3O
Molecular Weight100.04
InChIInChI=1S/C2H3F3O/c3-2(4,5)1-6/h6H,1H2
InChIKey RHQDFWAXVIIEBN-UHFFFAOYSA-N
SmilesC(O)C(F)(F)F
Mass
MS-NW-4405 2,2,2-trifluoroethanol C2H3F3O (Mass of molecular ion: 100)
Source Temperature: 240 °C Sample Temperature: 180 °C Reservoir, 75 eV
29.0 13.8 30.0 1.8 31.0 100.0 32.0 2.1 33.0 16.2 49.0 3.1 50.0 2.4 51.0 9.5 61.0 11.7 69.0 5.1 79.0 1.2 81.0 2.5 83.0 1.8
90 MHz in CDCl3
1H NMR | 89.56 MHz |
C2 H3 F3 O | 0.04 ml : 0.5 ml CDCl3 |
2,2,2-trifluoroethanol |
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Assign. Shift(ppm) |
Hz ppm Int.
364.06 4.065 347 355.38 3.969 979 346.94 3.874 1000 338.25 3.777 403 328.13 3.664 62 327.75 3.660 60 327.38 3.656 61 307.38 3.433 525
in CDCl3
liquid film
4880 A,200 M,liquid
2,2,2-Trifluoroethanol(75-89-8) IR1 Atlas of Related Products