Measured Mass (m/z)

Nitrogen Rule

No. of Nitrogen(s)*

Proposed Formula

Electron Paring

Calculated Mass (m/z)

Error** (ppm)

386.0781

ON

3

C16H15F3N3O3S+

[M+H]+

386.0781

0.0

268.0256

ON

1

C9H9F3NO3S+

EE

268.0250

2.2

250.0148

ON

1

C9H7F3NO2S+

EE

250.0144

1.6

220.0581

ON

1

C9H9F3NO2+

EE

220.0580

0.5

204.0636

ON

1

C9H9F3NO+

EE

204.0631

2.5

190.0472

ON

1

C8H7F3NO+

EE

190.0474

−1.1

152.0704

ON

1

C8H10NO2+

EE

152.0706

−1.3

119.0605

EN

2

C7H7N2+

EE

119.0604

0.8