CID 170910039

2-azabicyclo(3.1.0)hexane-2-sulfonyl chloride

Structural Information

Molecular Formula
C5H8ClNO2S
SMILES
C1CN(C2C1C2)S(=O)(=O)Cl
InChI
InChI=1S/C5H8ClNO2S/c6-10(8,9)7-2-1-4-3-5(4)7/h4-5H,1-3H2
InChIKey
YJGNTGVQUONCOL-UHFFFAOYSA-N
Compound name
2-azabicyclo[3.1.0]hexane-2-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

180.99643 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.00371 138.3
[M+Na]+ 203.98565 149.9
[M+NH4]+ 199.03025 147.5
[M+K]+ 219.95959 145.9
[M-H]- 179.98915 144.6
[M+Na-2H]- 201.97110 143.3
[M]+ 180.99588 143.4
[M]- 180.99698 143.4
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.