CID 165868870

1-(pyridin-2-yl)ethane-1-sulfonyl fluoride

Structural Information

Molecular Formula
C7H8FNO2S
SMILES
CC(C1=CC=CC=N1)S(=O)(=O)F
InChI
InChI=1S/C7H8FNO2S/c1-6(12(8,10)11)7-4-2-3-5-9-7/h2-6H,1H3
InChIKey
FQHGFRPTRVOIFI-UHFFFAOYSA-N
Compound name
1-pyridin-2-ylethanesulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

189.02597 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.033246 134.3
[M+Na]+ 212.015188 143.3
[M-H]- 188.018694 135.8
[M+NH4]+ 207.059793 153.0
[M+K]+ 227.989128 141.0
[M+H-H2O]+ 172.023230 127.5
[M+HCOO]- 234.024171 150.2
[M+CH3COO]- 248.039821 178.0
[M+Na-2H]- 210.000636 139.1
[M]+ 189.02542142 135.3
[M]- 189.02651858 135.3
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

No patent data available for this compound.