CID 59864252

2-(3-fluorophenyl)ethane-1-sulfonamide

Structural Information

Molecular Formula
C8H10FNO2S
SMILES
C1=CC(=CC(=C1)F)CCS(=O)(=O)N
InChI
InChI=1S/C8H10FNO2S/c9-8-3-1-2-7(6-8)4-5-13(10,11)12/h1-3,6H,4-5H2,(H2,10,11,12)
InChIKey
HTHSJXNTMSRBKJ-UHFFFAOYSA-N
Compound name
2-(3-fluorophenyl)ethanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

203.04163 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.04891 138.7
[M+Na]+ 226.03085 147.5
[M-H]- 202.03435 141.0
[M+NH4]+ 221.07545 157.8
[M+K]+ 242.00479 143.9
[M+H-H2O]+ 186.03889 132.1
[M+HCOO]- 248.03983 156.7
[M+CH3COO]- 262.05548 182.8
[M+Na-2H]- 224.01630 142.8
[M]+ 203.04108 138.7
[M]- 203.04218 138.7
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

patents stripe