CID 62085632

[4-(trifluoromethoxy)phenyl]methanesulfonamide

Structural Information

Molecular Formula
C8H8F3NO3S
SMILES
C1=CC(=CC=C1CS(=O)(=O)N)OC(F)(F)F
InChI
InChI=1S/C8H8F3NO3S/c9-8(10,11)15-7-3-1-6(2-4-7)5-16(12,13)14/h1-4H,5H2,(H2,12,13,14)
InChIKey
HJHZUVWKKWIBDB-UHFFFAOYSA-N
Compound name
[4-(trifluoromethoxy)phenyl]methanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

255.0177 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.02498 147.2
[M+Na]+ 278.00692 156.2
[M-H]- 254.01042 146.8
[M+NH4]+ 273.05152 164.0
[M+K]+ 293.98086 152.8
[M+H-H2O]+ 238.01496 138.9
[M+HCOO]- 300.01590 161.8
[M+CH3COO]- 314.03155 190.3
[M+Na-2H]- 275.99237 151.3
[M]+ 255.01715 145.7
[M]- 255.01825 145.7
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