CID 23318256

39643-08-8

Structural Information

Molecular Formula
C12H14N4
SMILES
C1=CC=NC(=C1)NCCNC2=CC=CC=N2
InChI
InChI=1S/C12H14N4/c1-3-7-13-11(5-1)15-9-10-16-12-6-2-4-8-14-12/h1-8H,9-10H2,(H,13,15)(H,14,16)
InChIKey
WZNXJKCIJMLBAE-UHFFFAOYSA-N
Compound name
N,N'-dipyridin-2-ylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

214.12184 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.129116 145.6
[M+Na]+ 237.111058 151.5
[M-H]- 213.114564 149.1
[M+NH4]+ 232.155663 160.4
[M+K]+ 253.084998 147.3
[M+H-H2O]+ 197.119100 136.1
[M+HCOO]- 259.120041 170.1
[M+CH3COO]- 273.135691 157.2
[M+Na-2H]- 235.096506 156.2
[M]+ 214.12129142 143.6
[M]- 214.12238858 143.6
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