CID 83872905

5-(1-amino-2-hydroxyethyl)piperidin-2-one

Structural Information

Molecular Formula
C7H14N2O2
SMILES
C1CC(=O)NCC1C(CO)N
InChI
InChI=1S/C7H14N2O2/c8-6(4-10)5-1-2-7(11)9-3-5/h5-6,10H,1-4,8H2,(H,9,11)
InChIKey
XYZZGQCTSIIEDV-UHFFFAOYSA-N
Compound name
5-(1-amino-2-hydroxyethyl)piperidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

158.10553 Da
Monoisotopic Mass

-1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.11281 135.6
[M+Na]+ 181.09475 140.0
[M-H]- 157.09825 133.9
[M+NH4]+ 176.13935 152.9
[M+K]+ 197.06869 137.8
[M+H-H2O]+ 141.10279 129.5
[M+HCOO]- 203.10373 152.1
[M+CH3COO]- 217.11938 173.4
[M+Na-2H]- 179.08020 138.1
[M]+ 158.10498 127.3
[M]- 158.10608 127.3
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.