CID 206521

50341-82-7

Structural Information

Molecular Formula
C20H29N3O
SMILES
CCCCN(CCN(CC)CC)C(=O)C1=NC2=CC=CC=C2C=C1
InChI
InChI=1S/C20H29N3O/c1-4-7-14-23(16-15-22(5-2)6-3)20(24)19-13-12-17-10-8-9-11-18(17)21-19/h8-13H,4-7,14-16H2,1-3H3
InChIKey
RVXIQMUDOOSWDY-UHFFFAOYSA-N
Compound name
N-butyl-N-[2-(diethylamino)ethyl]quinoline-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

327.23105 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 328.23833 183.9
[M+Na]+ 350.22027 187.3
[M-H]- 326.22377 188.2
[M+NH4]+ 345.26487 198.0
[M+K]+ 366.19421 184.9
[M+H-H2O]+ 310.22831 174.0
[M+HCOO]- 372.22925 205.6
[M+CH3COO]- 386.24490 223.5
[M+Na-2H]- 348.20572 186.8
[M]+ 327.23050 188.3
[M]- 327.23160 188.3
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.