CID 62655201

1-[2-(piperidin-1-yl)ethyl]piperidine-4-carbaldehyde

Structural Information

Molecular Formula
C13H24N2O
SMILES
C1CCN(CC1)CCN2CCC(CC2)C=O
InChI
InChI=1S/C13H24N2O/c16-12-13-4-8-15(9-5-13)11-10-14-6-2-1-3-7-14/h12-13H,1-11H2
InChIKey
JNRXJBAKSKVKEE-UHFFFAOYSA-N
Compound name
1-(2-piperidin-1-ylethyl)piperidine-4-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

224.18886 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.196136 156.7
[M+Na]+ 247.178078 158.6
[M-H]- 223.181584 158.2
[M+NH4]+ 242.222683 171.4
[M+K]+ 263.152018 156.0
[M+H-H2O]+ 207.186120 147.4
[M+HCOO]- 269.187061 170.4
[M+CH3COO]- 283.202711 188.9
[M+Na-2H]- 245.163526 158.3
[M]+ 224.18831142 148.9
[M]- 224.18940858 148.9
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.