CID 13721938

Propane-1-sulfonyl fluoride

Structural Information

Molecular Formula
C3H7FO2S
SMILES
CCCS(=O)(=O)F
InChI
InChI=1S/C3H7FO2S/c1-2-3-7(4,5)6/h2-3H2,1H3
InChIKey
ZTYOGLNTEZDFOL-UHFFFAOYSA-N
Compound name
propane-1-sulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

160
Patents

126.015076 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.02235 124.2
[M+Na]+ 149.00429 133.4
[M+NH4]+ 144.04890 131.5
[M+K]+ 164.97823 127.2
[M-H]- 125.00780 121.4
[M+Na-2H]- 146.98974 126.7
[M]+ 126.01453 124.9
[M]- 126.01562 124.9
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