CID 9555484

(1e)-1-pyridin-2-ylethanone quinolin-2-ylhydrazone

Structural Information

Molecular Formula
C16H14N4
SMILES
C/C(=N\NC1=NC2=CC=CC=C2C=C1)/C3=CC=CC=N3
InChI
InChI=1S/C16H14N4/c1-12(14-7-4-5-11-17-14)19-20-16-10-9-13-6-2-3-8-15(13)18-16/h2-11H,1H3,(H,18,20)/b19-12+
InChIKey
ZHXBMYNQHKXYCJ-XDHOZWIPSA-N
Compound name
N-[(E)-1-pyridin-2-ylethylideneamino]quinolin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

5
Patents

262.12186 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.12914 158.8
[M+Na]+ 285.11108 165.6
[M-H]- 261.11458 164.6
[M+NH4]+ 280.15568 173.2
[M+K]+ 301.08502 160.6
[M+H-H2O]+ 245.11912 148.4
[M+HCOO]- 307.12006 182.3
[M+CH3COO]- 321.13571 170.1
[M+Na-2H]- 283.09653 168.9
[M]+ 262.12131 157.7
[M]- 262.12241 157.7
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