CID 25195

Leniquinsin

Structural Information

Molecular Formula
C20H20N2O4
SMILES
COC1=C(C=C(C=C1)C=NC2=C3C=C(C(=CC3=NC=C2)OC)OC)OC
InChI
InChI=1S/C20H20N2O4/c1-23-17-6-5-13(9-18(17)24-2)12-22-15-7-8-21-16-11-20(26-4)19(25-3)10-14(15)16/h5-12H,1-4H3
InChIKey
JIGAQXOHSFIRIS-UHFFFAOYSA-N
Compound name
1-(3,4-dimethoxyphenyl)-N-(6,7-dimethoxyquinolin-4-yl)methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

382
Patents

352.1423 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 353.149576 183.4
[M+Na]+ 375.131518 192.5
[M-H]- 351.135024 191.5
[M+NH4]+ 370.176123 196.7
[M+K]+ 391.105458 189.3
[M+H-H2O]+ 335.139560 172.9
[M+HCOO]- 397.140501 207.3
[M+CH3COO]- 411.156151 220.4
[M+Na-2H]- 373.116966 188.7
[M]+ 352.14175142 191.5
[M]- 352.14284858 191.5
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.