CID 115011326

Cyclopropylmethanesulfonyl fluoride

Structural Information

Molecular Formula
C4H7FO2S
SMILES
C1CC1CS(=O)(=O)F
InChI
InChI=1S/C4H7FO2S/c5-8(6,7)3-4-1-2-4/h4H,1-3H2
InChIKey
BTKSWCSHCKZFKU-UHFFFAOYSA-N
Compound name
cyclopropylmethanesulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

138.01508 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.02236 120.4
[M+Na]+ 161.00430 130.8
[M-H]- 137.00780 124.2
[M+NH4]+ 156.04890 137.6
[M+K]+ 176.97824 128.5
[M+H-H2O]+ 121.01234 114.1
[M+HCOO]- 183.01328 138.1
[M+CH3COO]- 197.02893 172.6
[M+Na-2H]- 158.98975 125.6
[M]+ 138.01453 123.8
[M]- 138.01563 123.8
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