CID 8467985

3,4-difluoro-n-methylbenzene-1-sulfonamide

Structural Information

Molecular Formula
C7H7F2NO2S
SMILES
CNS(=O)(=O)C1=CC(=C(C=C1)F)F
InChI
InChI=1S/C7H7F2NO2S/c1-10-13(11,12)5-2-3-6(8)7(9)4-5/h2-4,10H,1H3
InChIKey
JPCRKIRQKGTNOH-UHFFFAOYSA-N
Compound name
3,4-difluoro-N-methylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

207.01656 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.02384 135.4
[M+Na]+ 230.00578 145.5
[M-H]- 206.00928 137.4
[M+NH4]+ 225.05038 154.9
[M+K]+ 245.97972 142.1
[M+H-H2O]+ 190.01382 128.2
[M+HCOO]- 252.01476 153.3
[M+CH3COO]- 266.03041 184.4
[M+Na-2H]- 227.99123 139.9
[M]+ 207.01601 135.4
[M]- 207.01711 135.4
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

patents stripe