CID 10728788

1-(2-phenylethyl)piperidin-4-amine

Structural Information

Molecular Formula
C13H20N2
SMILES
C1CN(CCC1N)CCC2=CC=CC=C2
InChI
InChI=1S/C13H20N2/c14-13-7-10-15(11-8-13)9-6-12-4-2-1-3-5-12/h1-5,13H,6-11,14H2
InChIKey
BCEKLYJIVXGPLQ-UHFFFAOYSA-N
Compound name
1-(2-phenylethyl)piperidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

184
Patents

204.16264 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.16992 148.3
[M+Na]+ 227.15186 152.4
[M-H]- 203.15536 152.0
[M+NH4]+ 222.19646 165.1
[M+K]+ 243.12580 148.7
[M+H-H2O]+ 187.15990 140.1
[M+HCOO]- 249.16084 167.8
[M+CH3COO]- 263.17649 187.9
[M+Na-2H]- 225.13731 152.6
[M]+ 204.16209 141.9
[M]- 204.16319 141.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe