CID 206898

28866-22-0

Structural Information

Molecular Formula
C23H38N2O2
SMILES
CCCN(CCC)CC1(CN(C(CC1(C2=CC=CC=C2)OC(=O)C)C)C)C
InChI
InChI=1S/C23H38N2O2/c1-7-14-25(15-8-2)18-22(5)17-24(6)19(3)16-23(22,27-20(4)26)21-12-10-9-11-13-21/h9-13,19H,7-8,14-18H2,1-6H3
InChIKey
DRVCNWAHZWZXOL-UHFFFAOYSA-N
Compound name
[5-[(dipropylamino)methyl]-1,2,5-trimethyl-4-phenylpiperidin-4-yl] acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

374.29333 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 375.30061 193.5
[M+Na]+ 397.28255 197.1
[M-H]- 373.28605 198.8
[M+NH4]+ 392.32715 208.8
[M+K]+ 413.25649 195.0
[M+H-H2O]+ 357.29059 185.2
[M+HCOO]- 419.29153 210.4
[M+CH3COO]- 433.30718 226.8
[M+Na-2H]- 395.26800 193.0
[M]+ 374.29278 195.9
[M]- 374.29388 195.9
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.