CID 4438618

1-benzyl-4-(n-boc-amino) piperidine

Structural Information

Molecular Formula
C17H26N2O2
SMILES
CC(C)(C)OC(=O)NC1CCN(CC1)CC2=CC=CC=C2
InChI
InChI=1S/C17H26N2O2/c1-17(2,3)21-16(20)18-15-9-11-19(12-10-15)13-14-7-5-4-6-8-14/h4-8,15H,9-13H2,1-3H3,(H,18,20)
InChIKey
WFKLUNLIZMWKNF-UHFFFAOYSA-N
Compound name
tert-butyl N-(1-benzylpiperidin-4-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

313
Patents

290.19943 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.20671 171.8
[M+Na]+ 313.18865 174.6
[M-H]- 289.19215 175.8
[M+NH4]+ 308.23325 185.4
[M+K]+ 329.16259 172.0
[M+H-H2O]+ 273.19669 163.3
[M+HCOO]- 335.19763 188.7
[M+CH3COO]- 349.21328 203.2
[M+Na-2H]- 311.17410 174.7
[M]+ 290.19888 168.7
[M]- 290.19998 168.7
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