CID 167736558

4-(chlorodifluoromethoxy)benzene-1-sulfonamide

Structural Information

Molecular Formula
C7H6ClF2NO3S
SMILES
C1=CC(=CC=C1OC(F)(F)Cl)S(=O)(=O)N
InChI
InChI=1S/C7H6ClF2NO3S/c8-7(9,10)14-5-1-3-6(4-2-5)15(11,12)13/h1-4H,(H2,11,12,13)
InChIKey
CQAYFLZMNDDGON-UHFFFAOYSA-N
Compound name
4-[chloro(difluoro)methoxy]benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.9725 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.97978 145.1
[M+Na]+ 279.96172 155.1
[M-H]- 255.96522 146.5
[M+NH4]+ 275.00632 162.8
[M+K]+ 295.93566 150.6
[M+H-H2O]+ 239.96976 139.0
[M+HCOO]- 301.97070 156.7
[M+CH3COO]- 315.98635 188.9
[M+Na-2H]- 277.94717 150.0
[M]+ 256.97195 146.5
[M]- 256.97305 146.5
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

No patent data available for this compound.