CID 45116644

3,5-dimethoxypyridin-4-amine

Structural Information

Molecular Formula
C7H10N2O2
SMILES
COC1=CN=CC(=C1N)OC
InChI
InChI=1S/C7H10N2O2/c1-10-5-3-9-4-6(11-2)7(5)8/h3-4H,1-2H3,(H2,8,9)
InChIKey
WGTFHDOGITXBBS-UHFFFAOYSA-N
Compound name
3,5-dimethoxypyridin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

154.07423 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.081506 129.5
[M+Na]+ 177.063448 138.7
[M-H]- 153.066954 132.0
[M+NH4]+ 172.108053 149.2
[M+K]+ 193.037388 137.8
[M+H-H2O]+ 137.071490 123.1
[M+HCOO]- 199.072431 154.3
[M+CH3COO]- 213.088081 178.4
[M+Na-2H]- 175.048896 136.7
[M]+ 154.07368142 131.1
[M]- 154.07477858 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