CID 84656710

2,2-difluoropropane-1-sulfonyl chloride

Structural Information

Molecular Formula
C3H5ClF2O2S
SMILES
CC(CS(=O)(=O)Cl)(F)F
InChI
InChI=1S/C3H5ClF2O2S/c1-3(5,6)2-9(4,7)8/h2H2,1H3
InChIKey
MUHVCEAOLHMMMB-UHFFFAOYSA-N
Compound name
2,2-difluoropropane-1-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

177.96669 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.97397 125.5
[M+Na]+ 200.95591 135.7
[M-H]- 176.95941 124.3
[M+NH4]+ 196.00051 147.0
[M+K]+ 216.92985 132.9
[M+H-H2O]+ 160.96395 121.2
[M+HCOO]- 222.96489 136.1
[M+CH3COO]- 236.98054 174.3
[M+Na-2H]- 198.94136 130.6
[M]+ 177.96614 127.4
[M]- 177.96724 127.4
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

patents stripe