CID 12213867

N-[(e)-benzylideneamino]-7-ethoxy-2-methyl-quinolin-4-amine

Structural Information

Molecular Formula
C19H19N3O
SMILES
CCOC1=CC2=NC(=CC(=C2C=C1)N/N=C/C3=CC=CC=C3)C
InChI
InChI=1S/C19H19N3O/c1-3-23-16-9-10-17-18(12-16)21-14(2)11-19(17)22-20-13-15-7-5-4-6-8-15/h4-13H,3H2,1-2H3,(H,21,22)/b20-13+
InChIKey
AEHGFJZWECLOMP-DEDYPNTBSA-N
Compound name
N-[(E)-benzylideneamino]-7-ethoxy-2-methylquinolin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

305.1528 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.16008 172.0
[M+Na]+ 328.14202 179.5
[M-H]- 304.14552 179.4
[M+NH4]+ 323.18662 186.6
[M+K]+ 344.11596 174.3
[M+H-H2O]+ 288.15006 161.9
[M+HCOO]- 350.15100 197.0
[M+CH3COO]- 364.16665 213.7
[M+Na-2H]- 326.12747 179.8
[M]+ 305.15225 174.2
[M]- 305.15335 174.2
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

No patent data available for this compound.