CID 10261179

6-(methylthio)pyridin-3-amine

Structural Information

Molecular Formula
C6H8N2S
SMILES
CSC1=NC=C(C=C1)N
InChI
InChI=1S/C6H8N2S/c1-9-6-3-2-5(7)4-8-6/h2-4H,7H2,1H3
InChIKey
BEMNZDZGBAGRAT-UHFFFAOYSA-N
Compound name
6-methylsulfanylpyridin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

107
Patents

140.04082 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.04810 125.4
[M+Na]+ 163.03004 138.0
[M+NH4]+ 158.07464 135.0
[M+K]+ 179.00398 129.7
[M-H]- 139.03354 128.5
[M+Na-2H]- 161.01549 132.6
[M]+ 140.04027 128.5
[M]- 140.04137 128.5
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

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