CID 119031264

(1-fluorocyclobutyl)methanesulfonyl chloride

Structural Information

Molecular Formula
C5H8ClFO2S
SMILES
C1CC(C1)(CS(=O)(=O)Cl)F
InChI
InChI=1S/C5H8ClFO2S/c6-10(8,9)4-5(7)2-1-3-5/h1-4H2
InChIKey
CVZWKGMVXFJMNE-UHFFFAOYSA-N
Compound name
(1-fluorocyclobutyl)methanesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

185.99176 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.99904 124.7
[M+Na]+ 208.98098 132.3
[M-H]- 184.98448 127.2
[M+NH4]+ 204.02558 141.0
[M+K]+ 224.95492 132.1
[M+H-H2O]+ 168.98902 116.3
[M+HCOO]- 230.98996 135.7
[M+CH3COO]- 245.00561 178.3
[M+Na-2H]- 206.96643 130.0
[M]+ 185.99121 135.1
[M]- 185.99231 135.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe