3,5-BIS(TRIFLUOROMETHYL)PHENYL ISOTHIOCYANATE(23165-29-9) IR1
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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![](https://www.chemicalbook.com/Spectrum/23165-29-9_MS.gif)
Mass
MS2001-00812WA
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