CID 23538

Li6ek1d3k8

Structural Information

Molecular Formula
C20H24N2O
SMILES
C1CN(CCC1(CNC=O)C2=CC=CC=C2)CC3=CC=CC=C3
InChI
InChI=1S/C20H24N2O/c23-17-21-16-20(19-9-5-2-6-10-19)11-13-22(14-12-20)15-18-7-3-1-4-8-18/h1-10,17H,11-16H2,(H,21,23)
InChIKey
VPSVRBGAMQZWAC-UHFFFAOYSA-N
Compound name
N-[(1-benzyl-4-phenylpiperidin-4-yl)methyl]formamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

34
Patents

308.18887 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.196146 175.2
[M+Na]+ 331.178088 178.7
[M-H]- 307.181594 182.0
[M+NH4]+ 326.222693 189.1
[M+K]+ 347.152028 173.3
[M+H-H2O]+ 291.186130 164.7
[M+HCOO]- 353.187071 194.7
[M+CH3COO]- 367.202721 184.5
[M+Na-2H]- 329.163536 180.2
[M]+ 308.18832142 170.5
[M]- 308.18941858 170.5
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

patents stripe