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

119
Patents

218.1419 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.14918 150.6
[M+Na]+ 241.13112 153.3
[M-H]- 217.13462 153.1
[M+NH4]+ 236.17572 165.8
[M+K]+ 257.10506 149.5
[M+H-H2O]+ 201.13916 142.4
[M+HCOO]- 263.14010 168.7
[M+CH3COO]- 277.15575 186.4
[M+Na-2H]- 239.11657 155.0
[M]+ 218.14135 143.0
[M]- 218.14245 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