CID 3060499

1,1-diphenyl-2-methyl-3-(1-methyl-4-piperidylamino)propanol dihydrochloride

Structural Information

Molecular Formula
C22H30N2O
SMILES
CC(CNC1CCN(CC1)C)C(C2=CC=CC=C2)(C3=CC=CC=C3)O
InChI
InChI=1S/C22H30N2O/c1-18(17-23-21-13-15-24(2)16-14-21)22(25,19-9-5-3-6-10-19)20-11-7-4-8-12-20/h3-12,18,21,23,25H,13-17H2,1-2H3
InChIKey
SYTTWLMUAWGWBV-UHFFFAOYSA-N
Compound name
2-methyl-3-[(1-methylpiperidin-4-yl)amino]-1,1-diphenylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

338.2358 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 339.24308 183.9
[M+Na]+ 361.22502 184.8
[M-H]- 337.22852 188.9
[M+NH4]+ 356.26962 193.9
[M+K]+ 377.19896 179.5
[M+H-H2O]+ 321.23306 173.9
[M+HCOO]- 383.23400 198.3
[M+CH3COO]- 397.24965 212.4
[M+Na-2H]- 359.21047 186.3
[M]+ 338.23525 177.4
[M]- 338.23635 177.4
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.