CID 200867

Brn 0397697

Structural Information

Molecular Formula
C12H20N4
SMILES
C1CCN(CC1)CCNC2=C(C=NC=C2)N
InChI
InChI=1S/C12H20N4/c13-11-10-14-5-4-12(11)15-6-9-16-7-2-1-3-8-16/h4-5,10H,1-3,6-9,13H2,(H,14,15)
InChIKey
UFRDIYNQZLTWRE-UHFFFAOYSA-N
Compound name
4-N-(2-piperidin-1-ylethyl)pyridine-3,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

220.1688 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.17608 152.1
[M+Na]+ 243.15802 162.8
[M+NH4]+ 238.20262 160.0
[M+K]+ 259.13196 155.8
[M-H]- 219.16152 156.3
[M+Na-2H]- 241.14347 159.4
[M]+ 220.16825 154.5
[M]- 220.16935 154.5
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.