CID 24777009

N-phenyl-2-[(2e)-2-(4-pyridylmethylene)hydrazino]quinoline-4-carboxamide

Structural Information

Molecular Formula
C22H17N5O
SMILES
C1=CC=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)N/N=C/C4=CC=NC=C4
InChI
InChI=1S/C22H17N5O/c28-22(25-17-6-2-1-3-7-17)19-14-21(26-20-9-5-4-8-18(19)20)27-24-15-16-10-12-23-13-11-16/h1-15H,(H,25,28)(H,26,27)/b24-15+
InChIKey
OVKBTFMDIBBNON-BUVRLJJBSA-N
Compound name
N-phenyl-2-[(2E)-2-(pyridin-4-ylmethylidene)hydrazinyl]quinoline-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

367.1433 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 368.15058 184.5
[M+Na]+ 390.13252 190.0
[M-H]- 366.13602 193.0
[M+NH4]+ 385.17712 193.6
[M+K]+ 406.10646 183.2
[M+H-H2O]+ 350.14056 172.0
[M+HCOO]- 412.14150 208.3
[M+CH3COO]- 426.15715 193.6
[M+Na-2H]- 388.11797 194.0
[M]+ 367.14275 183.0
[M]- 367.14385 183.0
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.