CID 101486

Dtxsid2064654

Structural Information

Molecular Formula
C15H12N4
SMILES
C1=CC=C2C(=C1)C=CC(=N2)NN=CC3=CC=CC=N3
InChI
InChI=1S/C15H12N4/c1-2-7-14-12(5-1)8-9-15(18-14)19-17-11-13-6-3-4-10-16-13/h1-11H,(H,18,19)
InChIKey
RQKUHYQNHJJIFO-UHFFFAOYSA-N
Compound name
N-(pyridin-2-ylmethylideneamino)quinolin-2-amine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

7
References

88
Patents

248.1062 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.113476 153.6
[M+Na]+ 271.095418 161.2
[M-H]- 247.098924 159.5
[M+NH4]+ 266.140023 168.6
[M+K]+ 287.069358 155.8
[M+H-H2O]+ 231.103460 143.3
[M+HCOO]- 293.104401 178.5
[M+CH3COO]- 307.120051 165.5
[M+Na-2H]- 269.080866 165.4
[M]+ 248.10565142 152.7
[M]- 248.10674858 152.7
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

No patent data available for this compound.