CID 14563235

Pyridine-3-sulfinic acid hydrochloride

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

45
Patents

143.0041 Da
Monoisotopic Mass

0.1
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

No literature data available for this compound.

Patent stripe

patents stripe