2-(Trifluoromethyl)phenothiazine(92-30-8) ¹H NMR

Product Name2-(Trifluoromethyl)phenothiazine

CAS 92-30-8

Molecular FormulaC13H8F3NS

Molecular Weight267.27

InChIInChI=1S/C13H8F3NS/c14-13(15,16)8-5-6-12-10(7-8)17-9-3-1-2-4-11(9)18-12/h1-7,17H

InChIKey RKGYJVASTMCSHZ-UHFFFAOYSA-N

SmilesC1=C2C(SC3=C(N2)C=CC=C3)=CC=C1C(F)(F)F

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Mass

MS2016-05335CW      
2-(trifluoromethyl)phenothiazine
C13H8F3NS           (Mass of molecular ion:    267)

   Source Temperature: 250 °C
   Sample Temperature:  20 °C
   Direct, 70 eV

      18.0       1.9
      39.0       1.2
      45.0       2.0
      50.0       1.2
      51.0       1.1
      63.0       2.3
      69.0       3.6
      75.0       1.4
      77.0       1.3
      95.0       1.3
      98.5       2.4
     101.5       2.9
     108.0       3.1
     108.5       4.1
     117.0       1.1
     123.0       1.1
     123.5       2.2
     133.0       1.3
     133.5      17.4
     134.5       1.0
     139.0       1.1
     153.0       1.7
     154.0       3.1
     157.0       1.1
     164.0       1.5
     165.0       1.5
     166.0       2.8
     169.0       1.0
     170.0       1.0
     171.0       2.0
     184.0       1.5
     185.0       2.2
     195.0       1.1
     196.0       5.0
     197.0       5.3
     198.0       6.9
     199.0       1.2
     202.0       2.5
     203.0       5.3
     207.0       1.2
     213.0       1.0
     214.0       1.7
     215.0       2.5
     216.0       4.6
     222.0       6.6
     223.0       1.8
     227.0       1.7
     228.0       2.9
     233.0       1.1
     234.0      10.9
     235.0      38.1
     236.0       5.3
     239.0       1.6
     246.0       4.5
     247.0      30.5
     248.0      10.3
     249.0       2.5
     265.0       1.3
     266.0      23.4
     267.0     100.0
     268.0      25.3
     269.0       8.7
     270.0       1.1

in DMSO-d6