CID 23342914

5-methanesulfinylpyridin-2-amine

Structural Information

Molecular Formula
C6H8N2OS
SMILES
CS(=O)C1=CN=C(C=C1)N
InChI
InChI=1S/C6H8N2OS/c1-10(9)5-2-3-6(7)8-4-5/h2-4H,1H3,(H2,7,8)
InChIKey
RYVCOMPFOKUUJB-UHFFFAOYSA-N
Compound name
5-methylsulfinylpyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

156.03574 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.04302 129.1
[M+Na]+ 179.02496 140.8
[M+NH4]+ 174.06956 137.6
[M+K]+ 194.99890 133.7
[M-H]- 155.02846 131.1
[M+Na-2H]- 177.01041 135.3
[M]+ 156.03519 131.6
[M]- 156.03629 131.6
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