CID 883967

N-(4-methylbenzyl)piperidine-4-carboxamide

Structural Information

Molecular Formula
C14H20N2O
SMILES
CC1=CC=C(C=C1)CNC(=O)C2CCNCC2
InChI
InChI=1S/C14H20N2O/c1-11-2-4-12(5-3-11)10-16-14(17)13-6-8-15-9-7-13/h2-5,13,15H,6-10H2,1H3,(H,16,17)
InChIKey
ULJXLBQGZILJIY-UHFFFAOYSA-N
Compound name
N-[(4-methylphenyl)methyl]piperidine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

232.15756 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.16484 155.4
[M+Na]+ 255.14678 158.6
[M-H]- 231.15028 158.1
[M+NH4]+ 250.19138 170.4
[M+K]+ 271.12072 154.6
[M+H-H2O]+ 215.15482 147.2
[M+HCOO]- 277.15576 173.0
[M+CH3COO]- 291.17141 190.5
[M+Na-2H]- 253.13223 158.5
[M]+ 232.15701 148.5
[M]- 232.15811 148.5
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