CID 115023297

(2-methoxyphenyl)methanesulfonyl fluoride

Structural Information

Molecular Formula
C8H9FO3S
SMILES
COC1=CC=CC=C1CS(=O)(=O)F
InChI
InChI=1S/C8H9FO3S/c1-12-8-5-3-2-4-7(8)6-13(9,10)11/h2-5H,6H2,1H3
InChIKey
VKDLIAYZYMQNKG-UHFFFAOYSA-N
Compound name
(2-methoxyphenyl)methanesulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

204.02565 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.03293 137.4
[M+Na]+ 227.01487 147.0
[M-H]- 203.01837 140.5
[M+NH4]+ 222.05947 157.2
[M+K]+ 242.98881 144.6
[M+H-H2O]+ 187.02291 131.2
[M+HCOO]- 249.02385 155.5
[M+CH3COO]- 263.03950 180.7
[M+Na-2H]- 225.00032 142.3
[M]+ 204.02510 140.8
[M]- 204.02620 140.8
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

No patent data available for this compound.