CID 89982

N-phenylpiperidin-4-amine

Structural Information

Molecular Formula
C11H16N2
SMILES
C1CNCCC1NC2=CC=CC=C2
InChI
InChI=1S/C11H16N2/c1-2-4-10(5-3-1)13-11-6-8-12-9-7-11/h1-5,11-13H,6-9H2
InChIKey
LKRMTUUCKBQGFO-UHFFFAOYSA-N
Compound name
N-phenylpiperidin-4-amine
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

1
References

697
Patents

176.13135 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.138626 138.8
[M+Na]+ 199.120568 142.3
[M-H]- 175.124074 141.5
[M+NH4]+ 194.165173 155.8
[M+K]+ 215.094508 138.6
[M+H-H2O]+ 159.128610 131.0
[M+HCOO]- 221.129551 158.1
[M+CH3COO]- 235.145201 149.7
[M+Na-2H]- 197.106016 145.5
[M]+ 176.13080142 130.4
[M]- 176.13189858 130.4
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