3,5-Bis(trifluoromethyl)phenyl isothiocyanate(23165-29-9) IR1
Product Name3,5-Bis(trifluoromethyl)phenyl isothiocyanate
CAS23165-29-9
Molecular FormulaC9H3F6NS
Molecular Weight271.18
InChIInChI=1S/C9H3F6NS/c10-8(11,12)5-1-6(9(13,14)15)3-7(2-5)16-4-17/h1-3H
InChIKey FXOSSGVJGGNASE-UHFFFAOYSA-N
SmilesC1(N=C=S)=CC(C(F)(F)F)=CC(C(F)(F)F)=C1
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MassMS2001-00812WA isothiocyanic acid 3,5-bis(trifluoromethyl)phenyl ester C9H3F6NS (Mass of molecular ion: 271)
Source Temperature: 300 °C Sample Temperature: 260 °C Reservoir, 70 eV
69.0 4.5 70.0 1.8 74.0 1.5 75.0 3.8 88.0 1.1 99.0 1.7 125.0 1.5 126.0 1.3 139.0 1.2 143.0 5.0 144.0 4.7 157.0 1.2 158.0 1.0 163.0 10.2 170.0 2.2 182.0 1.6 188.0 1.1 193.0 1.7 194.0 3.1 202.0 9.0 207.0 1.6 213.0 25.5 214.0 2.2 220.0 1.9 221.0 5.6 227.0 1.2 229.0 1.3 236.0 1.3 252.0 20.2 253.0 2.2 254.0 1.1 255.0 4.1 270.0 3.0 271.0 100.0 272.0 10.6 273.0 4.9
Liquid film
