CID 47002939

2-(pyridin-2-ylsulfanyl)pyridin-4-amine

Structural Information

Molecular Formula
C10H9N3S
SMILES
C1=CC=NC(=C1)SC2=NC=CC(=C2)N
InChI
InChI=1S/C10H9N3S/c11-8-4-6-13-10(7-8)14-9-3-1-2-5-12-9/h1-7H,(H2,11,13)
InChIKey
FIPQHRLWKOVLQN-UHFFFAOYSA-N
Compound name
2-pyridin-2-ylsulfanylpyridin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

203.05171 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.058986 140.3
[M+Na]+ 226.040928 149.5
[M-H]- 202.044434 144.3
[M+NH4]+ 221.085533 156.7
[M+K]+ 242.014868 144.4
[M+H-H2O]+ 186.048970 132.3
[M+HCOO]- 248.049911 158.8
[M+CH3COO]- 262.065561 152.9
[M+Na-2H]- 224.026376 146.3
[M]+ 203.05116142 139.9
[M]- 203.05225858 139.9
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.