CID 64018130

2-methanesulfonyl-2-methylpropanoyl chloride

Structural Information

Molecular Formula
C5H9ClO3S
SMILES
CC(C)(C(=O)Cl)S(=O)(=O)C
InChI
InChI=1S/C5H9ClO3S/c1-5(2,4(6)7)10(3,8)9/h1-3H3
InChIKey
WVAXTZRTHGFVMU-UHFFFAOYSA-N
Compound name
2-methyl-2-methylsulfonylpropanoyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

183.9961 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.003376 132.0
[M+Na]+ 206.985318 141.3
[M-H]- 182.988824 133.4
[M+NH4]+ 202.029923 153.3
[M+K]+ 222.959258 139.1
[M+H-H2O]+ 166.993360 129.4
[M+HCOO]- 228.994301 143.4
[M+CH3COO]- 243.009951 176.7
[M+Na-2H]- 204.970766 136.4
[M]+ 183.99555142 137.2
[M]- 183.99664858 137.2
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.