CID 12213912

2-fluorobenzaldehyde (7-ethoxy-2-methylquinolin-4-yl)hydrazone

Structural Information

Molecular Formula
C19H18FN3O
SMILES
CCOC1=CC2=NC(=CC(=C2C=C1)N/N=C/C3=CC=CC=C3F)C
InChI
InChI=1S/C19H18FN3O/c1-3-24-15-8-9-16-18(11-15)22-13(2)10-19(16)23-21-12-14-6-4-5-7-17(14)20/h4-12H,3H2,1-2H3,(H,22,23)/b21-12+
InChIKey
LTCMAPUKTIUGGW-CIAFOILYSA-N
Compound name
7-ethoxy-N-[(E)-(2-fluorophenyl)methylideneamino]-2-methylquinolin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

323.1434 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.15068 175.9
[M+Na]+ 346.13262 184.4
[M-H]- 322.13612 182.3
[M+NH4]+ 341.17722 190.0
[M+K]+ 362.10656 178.7
[M+H-H2O]+ 306.14066 164.9
[M+HCOO]- 368.14160 199.7
[M+CH3COO]- 382.15725 217.5
[M+Na-2H]- 344.11807 182.2
[M]+ 323.14285 177.4
[M]- 323.14395 177.4
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.