CID 165999947

N-(2-aminoethyl)-n-methylsulfamoyl fluoride hydrochloride

Structural Information

Molecular Formula
C3H9FN2O2S
SMILES
CN(CCN)S(=O)(=O)F
InChI
InChI=1S/C3H9FN2O2S/c1-6(3-2-5)9(4,7)8/h2-3,5H2,1H3
InChIKey
QGQKQOLQEJDWJX-UHFFFAOYSA-N
Compound name
N-(2-aminoethyl)-N-methylsulfamoyl fluoride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

156.03688 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.04416 126.8
[M+Na]+ 179.02610 134.3
[M-H]- 155.02960 127.0
[M+NH4]+ 174.07070 147.8
[M+K]+ 195.00004 134.0
[M+H-H2O]+ 139.03414 120.5
[M+HCOO]- 201.03508 145.9
[M+CH3COO]- 215.05073 179.7
[M+Na-2H]- 177.01155 130.8
[M]+ 156.03633 127.2
[M]- 156.03743 127.2
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.