CID 3053613

70166-95-9

Structural Information

Molecular Formula
C20H22ClN3O3
SMILES
C1CN(CCC1(C2=CC=CC=C2)O)CC(=O)NC(=O)NC3=CC=C(C=C3)Cl
InChI
InChI=1S/C20H22ClN3O3/c21-16-6-8-17(9-7-16)22-19(26)23-18(25)14-24-12-10-20(27,11-13-24)15-4-2-1-3-5-15/h1-9,27H,10-14H2,(H2,22,23,25,26)
InChIKey
TXCMSSWMUKUNBN-UHFFFAOYSA-N
Compound name
N-[(4-chlorophenyl)carbamoyl]-2-(4-hydroxy-4-phenylpiperidin-1-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

387.13498 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 388.14226 190.5
[M+Na]+ 410.12420 201.7
[M+NH4]+ 405.16880 198.1
[M+K]+ 426.09814 193.0
[M-H]- 386.12770 195.5
[M+Na-2H]- 408.10965 199.4
[M]+ 387.13443 193.6
[M]- 387.13553 193.6
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.