CID 59401689

4-phenyl-4-(pyrrolidin-1-yl)piperidine

Structural Information

Molecular Formula
C15H22N2
SMILES
C1CCN(C1)C2(CCNCC2)C3=CC=CC=C3
InChI
InChI=1S/C15H22N2/c1-2-6-14(7-3-1)15(8-10-16-11-9-15)17-12-4-5-13-17/h1-3,6-7,16H,4-5,8-13H2
InChIKey
CELGPXSFFNRYAY-UHFFFAOYSA-N
Compound name
4-phenyl-4-pyrrolidin-1-ylpiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

25
Patents

230.1783 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.18558 156.6
[M+Na]+ 253.16752 159.5
[M-H]- 229.17102 160.6
[M+NH4]+ 248.21212 173.7
[M+K]+ 269.14146 154.9
[M+H-H2O]+ 213.17556 147.0
[M+HCOO]- 275.17650 171.5
[M+CH3COO]- 289.19215 166.0
[M+Na-2H]- 251.15297 158.9
[M]+ 230.17775 146.4
[M]- 230.17885 146.4
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