3-(TRIFLUOROMETHYL)PHENETHYL ALCOHOL(455-01-6) 13C NMR
Product Name3-(TRIFLUOROMETHYL)PHENETHYL ALCOHOL
CAS455-01-6
Molecular FormulaC9H9F3O
Molecular Weight190.16
InChIInChI=1S/C9H9F3O/c10-9(11,12)8-3-1-2-7(6-8)4-5-13/h1-3,6,13H,4-5H2
InChIKey YDKIPCCKZKQMDT-UHFFFAOYSA-N
SmilesC1(CCO)=CC=CC(C(F)(F)F)=C1
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MassMS-NW-8735 m-(trifluoromethyl)phenethyl alcohol C9H9F3O (Mass of molecular ion: 190)
Source Temperature: 260 °C Sample Temperature: 150 °C Reservoir, 75 eV
27.0 2.0 29.0 1.7 31.0 32.0 38.0 1.1 39.0 4.9 43.0 1.3 44.0 1.9 50.0 2.5 51.0 4.3 57.0 1.9 59.0 2.3 62.0 1.8 63.0 5.3 64.0 1.3 65.0 2.4 69.0 1.5 74.0 1.1 75.0 3.7 77.0 2.6 83.0 2.9 88.0 1.1 89.0 5.3 90.0 2.7 91.0 54.3 92.0 4.3 95.0 2.1 96.0 1.3 99.0 2.0 101.0 2.0 102.0 1.0 103.0 1.7 107.0 1.5 109.0 23.1 110.0 1.8 113.0 1.7 114.0 3.4 119.0 9.6 120.0 2.5 121.0 1.6 127.0 2.7 133.0 1.8 138.0 1.4 139.0 5.7 140.0 59.4 141.0 7.7 145.0 2.2 151.0 2.8 158.0 1.4 159.0 67.3 160.0 100.0 161.0 8.6 169.0 1.1 170.0 3.2 171.0 9.1 172.0 3.3 173.0 2.0 190.0 21.3 191.0 2.1
in CDCl3
liquid film
