CID 5743468

N5,n5-dimethylpyridine-2,5-diamine

Structural Information

Molecular Formula
C7H11N3
SMILES
CN(C)C1=CN=C(C=C1)N
InChI
InChI=1S/C7H11N3/c1-10(2)6-3-4-7(8)9-5-6/h3-5H,1-2H3,(H2,8,9)
InChIKey
OLYQLAFJZQNFCK-UHFFFAOYSA-N
Compound name
5-N,5-N-dimethylpyridine-2,5-diamine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

131
Patents

137.09529 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.102566 127.5
[M+Na]+ 160.084508 135.2
[M-H]- 136.088014 131.2
[M+NH4]+ 155.129113 148.0
[M+K]+ 176.058448 134.6
[M+H-H2O]+ 120.092550 120.6
[M+HCOO]- 182.093491 153.4
[M+CH3COO]- 196.109141 181.5
[M+Na-2H]- 158.069956 135.0
[M]+ 137.09474142 126.3
[M]- 137.09583858 126.3
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

patents stripe