CID 6481989

2-diethylaminoethyl 8-hydroxyquinoline-7-carboxylate

Structural Information

Molecular Formula
C16H20N2O3
SMILES
CCN(CC)CCOC(=O)C1=C(C2=C(C=CC=N2)C=C1)O
InChI
InChI=1S/C16H20N2O3/c1-3-18(4-2)10-11-21-16(20)13-8-7-12-6-5-9-17-14(12)15(13)19/h5-9,19H,3-4,10-11H2,1-2H3
InChIKey
SQTQSHJOBKILOA-UHFFFAOYSA-N
Compound name
2-(diethylamino)ethyl 8-hydroxyquinoline-7-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

288.1474 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.15468 167.5
[M+Na]+ 311.13662 173.7
[M-H]- 287.14012 170.3
[M+NH4]+ 306.18122 182.5
[M+K]+ 327.11056 171.4
[M+H-H2O]+ 271.14466 159.2
[M+HCOO]- 333.14560 188.1
[M+CH3COO]- 347.16125 206.0
[M+Na-2H]- 309.12207 171.9
[M]+ 288.14685 171.4
[M]- 288.14795 171.4
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

No patent data available for this compound.