CID 126688674

2-fluoro-2-methylpropane-1-sulfonyl chloride

Structural Information

Molecular Formula
C4H8ClFO2S
SMILES
CC(C)(CS(=O)(=O)Cl)F
InChI
InChI=1S/C4H8ClFO2S/c1-4(2,6)3-9(5,7)8/h3H2,1-2H3
InChIKey
ZDKDKCJQILHICV-UHFFFAOYSA-N
Compound name
2-fluoro-2-methylpropane-1-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

173.99176 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.99904 128.4
[M+Na]+ 196.98098 138.2
[M-H]- 172.98448 128.4
[M+NH4]+ 192.02558 150.2
[M+K]+ 212.95492 135.5
[M+H-H2O]+ 156.98902 124.9
[M+HCOO]- 218.98996 139.6
[M+CH3COO]- 233.00561 174.6
[M+Na-2H]- 194.96643 133.4
[M]+ 173.99121 131.9
[M]- 173.99231 131.9
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