CID 4778217

1171497-43-0

Structural Information

Molecular Formula
C11H15N3O
SMILES
C1CN(CCC1N)C(=O)C2=CC=NC=C2
InChI
InChI=1S/C11H15N3O/c12-10-3-7-14(8-4-10)11(15)9-1-5-13-6-2-9/h1-2,5-6,10H,3-4,7-8,12H2
InChIKey
URGXEIDULPADAB-UHFFFAOYSA-N
Compound name
(4-aminopiperidin-1-yl)-pyridin-4-ylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

205.1215 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.128776 146.8
[M+Na]+ 228.110718 151.8
[M-H]- 204.114224 149.5
[M+NH4]+ 223.155323 162.0
[M+K]+ 244.084658 148.8
[M+H-H2O]+ 188.118760 137.9
[M+HCOO]- 250.119701 165.0
[M+CH3COO]- 264.135351 186.1
[M+Na-2H]- 226.096166 151.0
[M]+ 205.12095142 140.2
[M]- 205.12204858 140.2
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