CID 17754396

10,11-dimethoxy-4-methyldibenzo[c,f]-2,7-naphthyridine-3,6-diamine

Structural Information

Molecular Formula
C19H18N4O2
SMILES
CC1=C(C=CC2=C3C4=CC(=C(C=C4N=CC3=C(N=C12)N)OC)OC)N
InChI
InChI=1S/C19H18N4O2/c1-9-13(20)5-4-10-17-11-6-15(24-2)16(25-3)7-14(11)22-8-12(17)19(21)23-18(9)10/h4-8H,20H2,1-3H3,(H2,21,23)
InChIKey
NVINUNQBDNEMSY-UHFFFAOYSA-N
Compound name
2,3-dimethoxy-9-methylquinolino[3,4-c]quinoline-7,10-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

12
Patents

334.14297 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.150246 181.5
[M+Na]+ 357.132188 193.8
[M-H]- 333.135694 185.7
[M+NH4]+ 352.176793 195.5
[M+K]+ 373.106128 187.7
[M+H-H2O]+ 317.140230 171.8
[M+HCOO]- 379.141171 201.3
[M+CH3COO]- 393.156821 192.5
[M+Na-2H]- 355.117636 188.5
[M]+ 334.14242142 185.7
[M]- 334.14351858 185.7
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

patents stripe