CID 208704

32862-61-6

Structural Information

Molecular Formula
C21H33N3O2
SMILES
CCN(CC)CCCC(C)NC1=C(C2=C(C=CN=C2C(=C1)OC)C)OC
InChI
InChI=1S/C21H33N3O2/c1-7-24(8-2)13-9-10-16(4)23-17-14-18(25-5)20-19(21(17)26-6)15(3)11-12-22-20/h11-12,14,16,23H,7-10,13H2,1-6H3
InChIKey
KKCUDTFXAZXHQV-UHFFFAOYSA-N
Compound name
4-N-(5,8-dimethoxy-4-methylquinolin-6-yl)-1-N,1-N-diethylpentane-1,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

359.25726 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 360.26454 191.5
[M+Na]+ 382.24648 202.5
[M+NH4]+ 377.29108 198.0
[M+K]+ 398.22042 195.2
[M-H]- 358.24998 194.6
[M+Na-2H]- 380.23193 195.5
[M]+ 359.25671 193.8
[M]- 359.25781 193.8
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.