CID 24842222

88514-25-4

Structural Information

Molecular Formula
C20H36N4O2
SMILES
CC(C(=O)N1CCN(CC1)C(=O)CCN2CCCCC2)N3CCCCC3
InChI
InChI=1S/C20H36N4O2/c1-18(22-11-6-3-7-12-22)20(26)24-16-14-23(15-17-24)19(25)8-13-21-9-4-2-5-10-21/h18H,2-17H2,1H3
InChIKey
DVIHUICXRFWQBL-UHFFFAOYSA-N
Compound name
2-piperidin-1-yl-1-[4-(3-piperidin-1-ylpropanoyl)piperazin-1-yl]propan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

364.2838 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 365.29108 194.8
[M+Na]+ 387.27302 191.3
[M-H]- 363.27652 194.8
[M+NH4]+ 382.31762 199.6
[M+K]+ 403.24696 188.0
[M+H-H2O]+ 347.28106 181.8
[M+HCOO]- 409.28200 197.7
[M+CH3COO]- 423.29765 215.1
[M+Na-2H]- 385.25847 188.9
[M]+ 364.28325 182.2
[M]- 364.28435 182.2
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

No patent data available for this compound.