CID 82654842

2-(4,6-dimethoxypyridin-3-yl)ethan-1-amine

Structural Information

Molecular Formula
C9H14N2O2
SMILES
COC1=CC(=NC=C1CCN)OC
InChI
InChI=1S/C9H14N2O2/c1-12-8-5-9(13-2)11-6-7(8)3-4-10/h5-6H,3-4,10H2,1-2H3
InChIKey
VNZZWCLQJJQFAF-UHFFFAOYSA-N
Compound name
2-(4,6-dimethoxy-3-pyridinyl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

182.10553 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.112806 138.7
[M+Na]+ 205.094748 147.1
[M-H]- 181.098254 140.9
[M+NH4]+ 200.139353 157.3
[M+K]+ 221.068688 145.7
[M+H-H2O]+ 165.102790 131.9
[M+HCOO]- 227.103731 162.9
[M+CH3COO]- 241.119381 184.5
[M+Na-2H]- 203.080196 144.8
[M]+ 182.10498142 141.0
[M]- 182.10607858 141.0
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.