CID 49767240

4-(dimethylamino)-1-(2-methoxy-3-quinolyl)-2-methyl-1-phenyl-butan-2-ol

Structural Information

Molecular Formula
C23H28N2O2
SMILES
CC(CCN(C)C)(C(C1=CC=CC=C1)C2=CC3=CC=CC=C3N=C2OC)O
InChI
InChI=1S/C23H28N2O2/c1-23(26,14-15-25(2)3)21(17-10-6-5-7-11-17)19-16-18-12-8-9-13-20(18)24-22(19)27-4/h5-13,16,21,26H,14-15H2,1-4H3
InChIKey
BKIMVYGXIMCWOW-UHFFFAOYSA-N
Compound name
4-(dimethylamino)-1-(2-methoxyquinolin-3-yl)-2-methyl-1-phenylbutan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

364.2151 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 365.22238 191.3
[M+Na]+ 387.20432 195.7
[M-H]- 363.20782 196.6
[M+NH4]+ 382.24892 202.6
[M+K]+ 403.17826 191.7
[M+H-H2O]+ 347.21236 181.5
[M+HCOO]- 409.21330 208.6
[M+CH3COO]- 423.22895 222.5
[M+Na-2H]- 385.18977 195.3
[M]+ 364.21455 193.7
[M]- 364.21565 193.7
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.