CID 11564496

Lithium pyridine-2-sulfinate

Structural Information

Molecular Formula
C5H5NO2S
SMILES
C1=CC=NC(=C1)S(=O)O
InChI
InChI=1S/C5H5NO2S/c7-9(8)5-3-1-2-4-6-5/h1-4H,(H,7,8)
InChIKey
PTYNSKRKVPMPAX-UHFFFAOYSA-N
Compound name
pyridine-2-sulfinic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

51
Patents

143.0041 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.01138 124.5
[M+Na]+ 165.99332 136.6
[M+NH4]+ 161.03792 132.9
[M+K]+ 181.96726 129.7
[M-H]- 141.99682 125.4
[M+Na-2H]- 163.97877 130.8
[M]+ 143.00355 126.8
[M]- 143.00465 126.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe