CID 45050918

6-chloro-4-(4-morpholinyl)-2-phenylquinoline

Structural Information

Molecular Formula
C19H17ClN2O
SMILES
C1COCCN1C2=CC(=NC3=C2C=C(C=C3)Cl)C4=CC=CC=C4
InChI
InChI=1S/C19H17ClN2O/c20-15-6-7-17-16(12-15)19(22-8-10-23-11-9-22)13-18(21-17)14-4-2-1-3-5-14/h1-7,12-13H,8-11H2
InChIKey
XKDKQUBPJFYAPO-UHFFFAOYSA-N
Compound name
4-(6-chloro-2-phenylquinolin-4-yl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

324.10294 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.11022 176.3
[M+Na]+ 347.09216 183.9
[M-H]- 323.09566 183.5
[M+NH4]+ 342.13676 187.4
[M+K]+ 363.06610 177.7
[M+H-H2O]+ 307.10020 165.1
[M+HCOO]- 369.10114 187.3
[M+CH3COO]- 383.11679 186.0
[M+Na-2H]- 345.07761 181.5
[M]+ 324.10239 174.9
[M]- 324.10349 174.9
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.