CID 125424445

(1-fluorocyclopropyl)methanesulfonyl chloride

Structural Information

Molecular Formula
C4H6ClFO2S
SMILES
C1CC1(CS(=O)(=O)Cl)F
InChI
InChI=1S/C4H6ClFO2S/c5-9(7,8)3-4(6)1-2-4/h1-3H2
InChIKey
WFQALSZGXIQRPO-UHFFFAOYSA-N
Compound name
(1-fluorocyclopropyl)methanesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

171.9761 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.98338 123.1
[M+Na]+ 194.96532 134.3
[M-H]- 170.96882 127.0
[M+NH4]+ 190.00992 141.6
[M+K]+ 210.93926 131.4
[M+H-H2O]+ 154.97336 119.2
[M+HCOO]- 216.97430 136.1
[M+CH3COO]- 230.98995 175.9
[M+Na-2H]- 192.95077 129.5
[M]+ 171.97555 128.6
[M]- 171.97665 128.6
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