CID 4962477

1-(4-aminopiperidin-1-yl)ethan-1-one

Structural Information

Molecular Formula
C7H14N2O
SMILES
CC(=O)N1CCC(CC1)N
InChI
InChI=1S/C7H14N2O/c1-6(10)9-4-2-7(8)3-5-9/h7H,2-5,8H2,1H3
InChIKey
NLHBHVGPMMXWIM-UHFFFAOYSA-N
Compound name
1-(4-aminopiperidin-1-yl)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1231
Patents

142.11061 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.117886 131.7
[M+Na]+ 165.099828 137.1
[M-H]- 141.103334 133.0
[M+NH4]+ 160.144433 151.3
[M+K]+ 181.073768 136.3
[M+H-H2O]+ 125.107870 125.5
[M+HCOO]- 187.108811 151.1
[M+CH3COO]- 201.124461 175.6
[M+Na-2H]- 163.085276 135.3
[M]+ 142.11006142 125.7
[M]- 142.11115858 125.7
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