CID 131316551

1-(difluoromethyl)cyclopropane-1-sulfonyl chloride

Structural Information

Molecular Formula
C4H5ClF2O2S
SMILES
C1CC1(C(F)F)S(=O)(=O)Cl
InChI
InChI=1S/C4H5ClF2O2S/c5-10(8,9)4(1-2-4)3(6)7/h3H,1-2H2
InChIKey
WKZCWQUDXJVKCQ-UHFFFAOYSA-N
Compound name
1-(difluoromethyl)cyclopropane-1-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

189.96669 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.97397 139.0
[M+Na]+ 212.95591 148.2
[M+NH4]+ 208.00051 147.2
[M+K]+ 228.92985 142.5
[M-H]- 188.95941 142.2
[M+Na-2H]- 210.94136 145.2
[M]+ 189.96614 142.7
[M]- 189.96724 142.7
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.