CID 20115524

1016516-68-9

Structural Information

Molecular Formula
C7H6ClFO3S
SMILES
COC1=CC(=C(C=C1)S(=O)(=O)Cl)F
InChI
InChI=1S/C7H6ClFO3S/c1-12-5-2-3-7(6(9)4-5)13(8,10)11/h2-4H,1H3
InChIKey
PFWTYPSGDVPOPQ-UHFFFAOYSA-N
Compound name
2-fluoro-4-methoxybenzenesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

57
Patents

223.97102 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.978296 137.0
[M+Na]+ 246.960238 148.5
[M-H]- 222.963744 140.7
[M+NH4]+ 242.004843 157.1
[M+K]+ 262.934178 144.6
[M+H-H2O]+ 206.968280 132.2
[M+HCOO]- 268.969221 150.9
[M+CH3COO]- 282.984871 182.7
[M+Na-2H]- 244.945686 141.5
[M]+ 223.97047142 142.3
[M]- 223.97156858 142.3
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