CID 206904

4-piperidinol, 5-morpholinomethyl-4-phenyl-1,2,5-trimethyl-, acetate, dihydrochloride

Structural Information

Molecular Formula
C21H32N2O3
SMILES
CC1CC(C(CN1C)(C)CN2CCOCC2)(C3=CC=CC=C3)OC(=O)C
InChI
InChI=1S/C21H32N2O3/c1-17-14-21(26-18(2)24,19-8-6-5-7-9-19)20(3,15-22(17)4)16-23-10-12-25-13-11-23/h5-9,17H,10-16H2,1-4H3
InChIKey
RFCKSFMQECQRFH-UHFFFAOYSA-N
Compound name
[1,2,5-trimethyl-5-(morpholin-4-ylmethyl)-4-phenylpiperidin-4-yl] acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

360.2413 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 361.24858 189.6
[M+Na]+ 383.23052 201.1
[M+NH4]+ 378.27512 198.9
[M+K]+ 399.20446 190.9
[M-H]- 359.23402 195.0
[M+Na-2H]- 381.21597 197.5
[M]+ 360.24075 193.0
[M]- 360.24185 193.0
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.