CID 3868064

N-benzylpiperidine-4-carboxamide hydrochloride

Structural Information

Molecular Formula
C13H18N2O
SMILES
C1CNCCC1C(=O)NCC2=CC=CC=C2
InChI
InChI=1S/C13H18N2O/c16-13(12-6-8-14-9-7-12)15-10-11-4-2-1-3-5-11/h1-5,12,14H,6-10H2,(H,15,16)
InChIKey
KKXCMMIWHOYQCM-UHFFFAOYSA-N
Compound name
N-benzylpiperidine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

144
Patents

218.1419 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.149176 150.6
[M+Na]+ 241.131118 153.3
[M-H]- 217.134624 153.1
[M+NH4]+ 236.175723 165.8
[M+K]+ 257.105058 149.5
[M+H-H2O]+ 201.139160 142.4
[M+HCOO]- 263.140101 168.7
[M+CH3COO]- 277.155751 186.4
[M+Na-2H]- 239.116566 155.0
[M]+ 218.14135142 143.0
[M]- 218.14244858 143.0
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