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]+ 204.05899 140.3
[M+Na]+ 226.04093 149.5
[M-H]- 202.04443 144.3
[M+NH4]+ 221.08553 156.7
[M+K]+ 242.01487 144.4
[M+H-H2O]+ 186.04897 132.3
[M+HCOO]- 248.04991 158.8
[M+CH3COO]- 262.06556 152.9
[M+Na-2H]- 224.02638 146.3
[M]+ 203.05116 139.9
[M]- 203.05226 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.