CID 16771174

N-[2-amino-4-(trifluoromethyl)phenyl]methanesulfonamide

Structural Information

Molecular Formula
C8H9F3N2O2S
SMILES
CS(=O)(=O)NC1=C(C=C(C=C1)C(F)(F)F)N
InChI
InChI=1S/C8H9F3N2O2S/c1-16(14,15)13-7-3-2-5(4-6(7)12)8(9,10)11/h2-4,13H,12H2,1H3
InChIKey
QZLFTWBTXDWEFZ-UHFFFAOYSA-N
Compound name
N-[2-amino-4-(trifluoromethyl)phenyl]methanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

254.03368 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.04096 153.2
[M+Na]+ 277.02290 159.5
[M+NH4]+ 272.06750 157.5
[M+K]+ 292.99684 154.8
[M-H]- 253.02640 149.5
[M+Na-2H]- 275.00835 155.7
[M]+ 254.03313 153.0
[M]- 254.03423 153.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe