CID 130645149

1934421-18-7

Structural Information

Molecular Formula
C4H6BrClO2S
SMILES
C1CC1(CS(=O)(=O)Cl)Br
InChI
InChI=1S/C4H6BrClO2S/c5-4(1-2-4)3-9(6,7)8/h1-3H2
InChIKey
GWMDRNFWIWXODC-UHFFFAOYSA-N
Compound name
(1-bromocyclopropyl)methanesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

231.89604 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.90332 125.9
[M+Na]+ 254.88526 141.2
[M-H]- 230.88876 133.9
[M+NH4]+ 249.92986 146.2
[M+K]+ 270.85920 129.2
[M+H-H2O]+ 214.89330 128.6
[M+HCOO]- 276.89424 138.4
[M+CH3COO]- 290.90989 183.5
[M+Na-2H]- 252.87071 134.7
[M]+ 231.89549 150.0
[M]- 231.89659 150.0
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.