CID 588007

N-fluorobenzenesulfonimide

Structural Information

Molecular Formula
C12H10FNO4S2
SMILES
C1=CC=C(C=C1)S(=O)(=O)N(F)S(=O)(=O)C2=CC=CC=C2
InChI
InChI=1S/C12H10FNO4S2/c13-14(19(15,16)11-7-3-1-4-8-11)20(17,18)12-9-5-2-6-10-12/h1-10H
InChIKey
RLKHFSNWQCZBDC-UHFFFAOYSA-N
Compound name
N-(benzenesulfonyl)-N-fluorobenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

34
References

10039
Patents

315.00354 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 316.01082 166.4
[M+Na]+ 337.99276 174.3
[M-H]- 313.99626 172.7
[M+NH4]+ 333.03736 180.9
[M+K]+ 353.96670 169.8
[M+H-H2O]+ 298.00080 158.1
[M+HCOO]- 360.00174 179.5
[M+CH3COO]- 374.01739 201.1
[M+Na-2H]- 335.97821 171.9
[M]+ 315.00299 168.8
[M]- 315.00409 168.8
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.