CID 56604709

2-methylpropane-1-sulfonyl fluoride

Structural Information

Molecular Formula
C4H9FO2S
SMILES
CC(C)CS(=O)(=O)F
InChI
InChI=1S/C4H9FO2S/c1-4(2)3-8(5,6)7/h4H,3H2,1-2H3
InChIKey
FQGRTWKPZRVHRY-UHFFFAOYSA-N
Compound name
2-methylpropane-1-sulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

140.03073 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.03801 128.6
[M+Na]+ 163.01995 137.3
[M+NH4]+ 158.06455 135.6
[M+K]+ 178.99389 131.6
[M-H]- 139.02345 125.5
[M+Na-2H]- 161.00540 130.6
[M]+ 140.03018 129.1
[M]- 140.03128 129.1
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

patents stripe