CID 13345717

1-aminopiperidin-2-one

Structural Information

Molecular Formula
C5H10N2O
SMILES
C1CCN(C(=O)C1)N
InChI
InChI=1S/C5H10N2O/c6-7-4-2-1-3-5(7)8/h1-4,6H2
InChIKey
MDCDHGVIPGMQNR-UHFFFAOYSA-N
Compound name
1-aminopiperidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

273
Patents

114.079315 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 115.08659 122.0
[M+Na]+ 137.06853 128.4
[M-H]- 113.07204 123.4
[M+NH4]+ 132.11314 142.7
[M+K]+ 153.04247 127.6
[M+H-H2O]+ 97.076575 116.0
[M+HCOO]- 159.07752 143.0
[M+CH3COO]- 173.09317 169.2
[M+Na-2H]- 135.05398 127.9
[M]+ 114.07877 116.0
[M]- 114.07986 116.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe