CID 3024970

Quinoline, 2-(3-(dimethylamino)propoxy)-4-phenyl-, hydrochloride, hydrate

Structural Information

Molecular Formula
C20H22N2O
SMILES
CN(C)CCCOC1=NC2=CC=CC=C2C(=C1)C3=CC=CC=C3
InChI
InChI=1S/C20H22N2O/c1-22(2)13-8-14-23-20-15-18(16-9-4-3-5-10-16)17-11-6-7-12-19(17)21-20/h3-7,9-12,15H,8,13-14H2,1-2H3
InChIKey
BWVMDVZNIYEOIO-UHFFFAOYSA-N
Compound name
N,N-dimethyl-3-(4-phenylquinolin-2-yl)oxypropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

306.17322 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.18050 174.5
[M+Na]+ 329.16244 190.2
[M+NH4]+ 324.20704 183.8
[M+K]+ 345.13638 180.5
[M-H]- 305.16594 181.0
[M+Na-2H]- 327.14789 184.7
[M]+ 306.17267 178.8
[M]- 306.17377 178.8
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.