CID 61427416

N5-(2-methoxyethyl)-n5-methylpyridine-2,5-diamine

Structural Information

Molecular Formula
C9H15N3O
SMILES
CN(CCOC)C1=CN=C(C=C1)N
InChI
InChI=1S/C9H15N3O/c1-12(5-6-13-2)8-3-4-9(10)11-7-8/h3-4,7H,5-6H2,1-2H3,(H2,10,11)
InChIKey
HHJDARBBDLVPJM-UHFFFAOYSA-N
Compound name
5-N-(2-methoxyethyl)-5-N-methylpyridine-2,5-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

36
Patents

181.1215 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.12878 139.7
[M+Na]+ 204.11072 146.5
[M-H]- 180.11422 143.0
[M+NH4]+ 199.15532 158.4
[M+K]+ 220.08466 145.9
[M+H-H2O]+ 164.11876 132.2
[M+HCOO]- 226.11970 165.2
[M+CH3COO]- 240.13535 189.7
[M+Na-2H]- 202.09617 146.1
[M]+ 181.12095 140.7
[M]- 181.12205 140.7
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