CID 45122166

2,4-dimethoxypyridin-3-amine

Structural Information

Molecular Formula
C7H10N2O2
SMILES
COC1=C(C(=NC=C1)OC)N
InChI
InChI=1S/C7H10N2O2/c1-10-5-3-4-9-7(11-2)6(5)8/h3-4H,8H2,1-2H3
InChIKey
WYDJMYLLHJKBGT-UHFFFAOYSA-N
Compound name
2,4-dimethoxypyridin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

100
Patents

154.07423 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.08151 129.5
[M+Na]+ 177.06345 138.7
[M-H]- 153.06695 132.0
[M+NH4]+ 172.10805 149.2
[M+K]+ 193.03739 137.8
[M+H-H2O]+ 137.07149 123.1
[M+HCOO]- 199.07243 154.3
[M+CH3COO]- 213.08808 178.4
[M+Na-2H]- 175.04890 136.7
[M]+ 154.07368 131.1
[M]- 154.07478 131.1
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