CID 6486621

3-amino-1-(piperidin-1-yl)propan-1-one hydrochloride

Structural Information

Molecular Formula
C8H16N2O
SMILES
C1CCN(CC1)C(=O)CCN
InChI
InChI=1S/C8H16N2O/c9-5-4-8(11)10-6-2-1-3-7-10/h1-7,9H2
InChIKey
WXNXYKNQQCRFSR-UHFFFAOYSA-N
Compound name
3-amino-1-piperidin-1-ylpropan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

51
Patents

156.12627 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.13355 136.4
[M+Na]+ 179.11549 140.4
[M-H]- 155.11899 137.1
[M+NH4]+ 174.16009 155.1
[M+K]+ 195.08943 139.3
[M+H-H2O]+ 139.12353 129.6
[M+HCOO]- 201.12447 155.5
[M+CH3COO]- 215.14012 177.5
[M+Na-2H]- 177.10094 140.1
[M]+ 156.12572 130.4
[M]- 156.12682 130.4
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