CID 21546144

2-aminoethane-1-sulfonyl fluoride hydrochloride

Structural Information

Molecular Formula
C2H6FNO2S
SMILES
C(CS(=O)(=O)F)N
InChI
InChI=1S/C2H6FNO2S/c3-7(5,6)2-1-4/h1-2,4H2
InChIKey
LAQDLNOKUZORHU-UHFFFAOYSA-N
Compound name
2-aminoethanesulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

127.01033 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.01761 118.8
[M+Na]+ 149.99955 127.5
[M-H]- 126.00305 117.9
[M+NH4]+ 145.04415 140.8
[M+K]+ 165.97349 126.2
[M+H-H2O]+ 110.00759 113.5
[M+HCOO]- 172.00853 136.8
[M+CH3COO]- 186.02418 168.2
[M+Na-2H]- 147.98500 123.5
[M]+ 127.00978 118.4
[M]- 127.01088 118.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe