CID 3772

Piperidine-4-carboxamide

Structural Information

Molecular Formula
C6H12N2O
SMILES
C1CNCCC1C(=O)N
InChI
InChI=1S/C6H12N2O/c7-6(9)5-1-3-8-4-2-5/h5,8H,1-4H2,(H2,7,9)
InChIKey
DPBWFNDFMCCGGJ-UHFFFAOYSA-N
Compound name
piperidine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

23
References

7939
Patents

128.09496 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.102236 127.8
[M+Na]+ 151.084178 132.1
[M-H]- 127.087684 127.3
[M+NH4]+ 146.128783 146.8
[M+K]+ 167.058118 130.6
[M+H-H2O]+ 111.092220 121.6
[M+HCOO]- 173.093161 146.0
[M+CH3COO]- 187.108811 169.5
[M+Na-2H]- 149.069626 132.1
[M]+ 128.09441142 119.2
[M]- 128.09550858 119.2
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