CID 60824373

2-bromo-n-cyclopropyl-4-fluorobenzene-1-sulfonamide

Structural Information

Molecular Formula
C9H9BrFNO2S
SMILES
C1CC1NS(=O)(=O)C2=C(C=C(C=C2)F)Br
InChI
InChI=1S/C9H9BrFNO2S/c10-8-5-6(11)1-4-9(8)15(13,14)12-7-2-3-7/h1,4-5,7,12H,2-3H2
InChIKey
NSWWHFJQXKZEID-UHFFFAOYSA-N
Compound name
2-bromo-N-cyclopropyl-4-fluorobenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

292.95215 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.95943 141.8
[M+Na]+ 315.94137 155.6
[M-H]- 291.94487 150.8
[M+NH4]+ 310.98597 157.0
[M+K]+ 331.91531 142.4
[M+H-H2O]+ 275.94941 140.3
[M+HCOO]- 337.95035 158.7
[M+CH3COO]- 351.96600 198.4
[M+Na-2H]- 313.92682 148.3
[M]+ 292.95160 162.4
[M]- 292.95270 162.4
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.