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]+ 225.19614 156.7
[M+Na]+ 247.17808 158.6
[M-H]- 223.18158 158.2
[M+NH4]+ 242.22268 171.4
[M+K]+ 263.15202 156.0
[M+H-H2O]+ 207.18612 147.4
[M+HCOO]- 269.18706 170.4
[M+CH3COO]- 283.20271 188.9
[M+Na-2H]- 245.16353 158.3
[M]+ 224.18831 148.9
[M]- 224.18941 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.