CID 459707

2-[[8-(2-diethylaminoethylamino)-6-quinolyl]oxy]ethanol

Structural Information

Molecular Formula
C17H25N3O2
SMILES
CCN(CC)CCNC1=C2C(=CC(=C1)OCCO)C=CC=N2
InChI
InChI=1S/C17H25N3O2/c1-3-20(4-2)9-8-18-16-13-15(22-11-10-21)12-14-6-5-7-19-17(14)16/h5-7,12-13,18,21H,3-4,8-11H2,1-2H3
InChIKey
BMQCKKITXNTCIN-UHFFFAOYSA-N
Compound name
2-[8-[2-(diethylamino)ethylamino]quinolin-6-yl]oxyethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

303.19467 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.20195 172.7
[M+Na]+ 326.18389 177.6
[M-H]- 302.18739 175.1
[M+NH4]+ 321.22849 186.9
[M+K]+ 342.15783 174.5
[M+H-H2O]+ 286.19193 163.8
[M+HCOO]- 348.19287 194.6
[M+CH3COO]- 362.20852 212.6
[M+Na-2H]- 324.16934 178.3
[M]+ 303.19412 176.3
[M]- 303.19522 176.3
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.