CID 81528

13103-75-8

Structural Information

Molecular Formula
C13H14N4
SMILES
CN(C)C1=CC=C(C=C1)N=NC2=CC=CC=N2
InChI
InChI=1S/C13H14N4/c1-17(2)12-8-6-11(7-9-12)15-16-13-5-3-4-10-14-13/h3-10H,1-2H3
InChIKey
IOJNPSPGHUEJAQ-UHFFFAOYSA-N
Compound name
N,N-dimethyl-4-(pyridin-2-yldiazenyl)aniline
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

8
References

1167
Patents

226.12184 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.129116 149.9
[M+Na]+ 249.111058 156.6
[M-H]- 225.114564 159.3
[M+NH4]+ 244.155663 167.5
[M+K]+ 265.084998 155.2
[M+H-H2O]+ 209.119100 140.0
[M+HCOO]- 271.120041 180.0
[M+CH3COO]- 285.135691 204.6
[M+Na-2H]- 247.096506 159.3
[M]+ 226.12129142 151.6
[M]- 226.12238858 151.6
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