CID 155819326

2137818-26-7

Structural Information

Molecular Formula
C7H5FN2O3S
SMILES
C1=CC2=C(C=C1S(=O)(=O)F)NC(=O)N2
InChI
InChI=1S/C7H5FN2O3S/c8-14(12,13)4-1-2-5-6(3-4)10-7(11)9-5/h1-3H,(H2,9,10,11)
InChIKey
HOXGCGPCGUEMFZ-UHFFFAOYSA-N
Compound name
2-oxo-1,3-dihydrobenzimidazole-5-sulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

216.00049 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.00777 141.6
[M+Na]+ 238.98971 152.6
[M+NH4]+ 234.03431 147.4
[M+K]+ 254.96365 148.5
[M-H]- 214.99321 138.6
[M+Na-2H]- 236.97516 145.1
[M]+ 215.99994 142.5
[M]- 216.00104 142.5
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.