CID 364175

Nsc629875

Structural Information

Molecular Formula
C18H16N2O
SMILES
CCOC1=CC=C(C=C1)N=CC2=CC=CC3=C2N=CC=C3
InChI
InChI=1S/C18H16N2O/c1-2-21-17-10-8-16(9-11-17)20-13-15-6-3-5-14-7-4-12-19-18(14)15/h3-13H,2H2,1H3
InChIKey
NLBORTCRDYWWKY-UHFFFAOYSA-N
Compound name
N-(4-ethoxyphenyl)-1-quinolin-8-ylmethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

276.12625 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.13353 163.8
[M+Na]+ 299.11547 171.8
[M-H]- 275.11897 171.2
[M+NH4]+ 294.16007 179.7
[M+K]+ 315.08941 166.7
[M+H-H2O]+ 259.12351 154.1
[M+HCOO]- 321.12445 188.2
[M+CH3COO]- 335.14010 175.9
[M+Na-2H]- 297.10092 172.4
[M]+ 276.12570 165.9
[M]- 276.12680 165.9
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.