CID 3074832

Piperidine, 1-((2-phenyl-1h-indol-1-yl)acetyl)-

Structural Information

Molecular Formula
C21H22N2O
SMILES
C1CCN(CC1)C(=O)CN2C3=CC=CC=C3C=C2C4=CC=CC=C4
InChI
InChI=1S/C21H22N2O/c24-21(22-13-7-2-8-14-22)16-23-19-12-6-5-11-18(19)15-20(23)17-9-3-1-4-10-17/h1,3-6,9-12,15H,2,7-8,13-14,16H2
InChIKey
WDDXTTAIAHSQLJ-UHFFFAOYSA-N
Compound name
2-(2-phenylindol-1-yl)-1-piperidin-1-ylethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

318.17322 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.18050 177.0
[M+Na]+ 341.16244 182.8
[M-H]- 317.16594 184.1
[M+NH4]+ 336.20704 190.5
[M+K]+ 357.13638 176.5
[M+H-H2O]+ 301.17048 166.3
[M+HCOO]- 363.17142 194.6
[M+CH3COO]- 377.18707 186.7
[M+Na-2H]- 339.14789 178.9
[M]+ 318.17267 174.1
[M]- 318.17377 174.1
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.