CID 85598607

Pipamperone metabolite m-vi

Structural Information

Molecular Formula
C11H19N3O
SMILES
C1CN(CC=C1)C2(CCNCC2)C(=O)N
InChI
InChI=1S/C11H19N3O/c12-10(15)11(4-6-13-7-5-11)14-8-2-1-3-9-14/h1-2,13H,3-9H2,(H2,12,15)
InChIKey
DVFTWVSQMSTJHX-UHFFFAOYSA-N
Compound name
4-(3,6-dihydro-2H-pyridin-1-yl)piperidine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

209.15282 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.16010 150.5
[M+Na]+ 232.14204 152.9
[M-H]- 208.14554 151.0
[M+NH4]+ 227.18664 166.3
[M+K]+ 248.11598 150.0
[M+H-H2O]+ 192.15008 142.3
[M+HCOO]- 254.15102 164.3
[M+CH3COO]- 268.16667 183.5
[M+Na-2H]- 230.12749 153.9
[M]+ 209.15227 139.3
[M]- 209.15337 139.3
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

No patent data available for this compound.