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

1341
Patents

142.11061 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.11789 131.7
[M+Na]+ 165.09983 137.1
[M-H]- 141.10333 133.0
[M+NH4]+ 160.14443 151.3
[M+K]+ 181.07377 136.3
[M+H-H2O]+ 125.10787 125.5
[M+HCOO]- 187.10881 151.1
[M+CH3COO]- 201.12446 175.6
[M+Na-2H]- 163.08528 135.3
[M]+ 142.11006 125.7
[M]- 142.11116 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