CID 53964049

4-fluorobutane-1-sulfonamide

Structural Information

Molecular Formula
C4H10FNO2S
SMILES
C(CCS(=O)(=O)N)CF
InChI
InChI=1S/C4H10FNO2S/c5-3-1-2-4-9(6,7)8/h1-4H2,(H2,6,7,8)
InChIKey
JMYLSJUTCALFTM-UHFFFAOYSA-N
Compound name
4-fluorobutane-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

155.04163 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.04891 127.7
[M+Na]+ 178.03085 135.6
[M-H]- 154.03435 126.5
[M+NH4]+ 173.07545 148.6
[M+K]+ 194.00479 133.8
[M+H-H2O]+ 138.03889 122.1
[M+HCOO]- 200.03983 145.2
[M+CH3COO]- 214.05548 174.3
[M+Na-2H]- 176.01630 131.5
[M]+ 155.04108 128.1
[M]- 155.04218 128.1
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