CID 167729669

2-bromo-4-(difluoromethyl)benzene-1-sulfonamide

Structural Information

Molecular Formula
C7H6BrF2NO2S
SMILES
C1=CC(=C(C=C1C(F)F)Br)S(=O)(=O)N
InChI
InChI=1S/C7H6BrF2NO2S/c8-5-3-4(7(9)10)1-2-6(5)14(11,12)13/h1-3,7H,(H2,11,12,13)
InChIKey
FYWZSNLXOHOAHW-UHFFFAOYSA-N
Compound name
2-bromo-4-(difluoromethyl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.92706 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.93434 143.4
[M+Na]+ 307.91628 143.9
[M+NH4]+ 302.96088 146.3
[M+K]+ 323.89022 144.4
[M-H]- 283.91978 140.6
[M+Na-2H]- 305.90173 144.8
[M]+ 284.92651 141.7
[M]- 284.92761 141.7
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

No patent data available for this compound.