CID 96223340

Rac-(5r,6s)-5-amino-6-cyclopropylpiperidin-2-one hydrochloride

Structural Information

Molecular Formula
C8H14N2O
SMILES
C1CC(=O)N[C@H]([C@@H]1N)C2CC2
InChI
InChI=1S/C8H14N2O/c9-6-3-4-7(11)10-8(6)5-1-2-5/h5-6,8H,1-4,9H2,(H,10,11)/t6-,8+/m1/s1
InChIKey
UONMIDTZTLDYFU-SVRRBLITSA-N
Compound name
(5R,6S)-5-amino-6-cyclopropylpiperidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

154.11061 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.11789 134.6
[M+Na]+ 177.09983 142.3
[M-H]- 153.10333 138.7
[M+NH4]+ 172.14443 148.4
[M+K]+ 193.07377 138.4
[M+H-H2O]+ 137.10787 128.0
[M+HCOO]- 199.10881 153.7
[M+CH3COO]- 213.12446 179.1
[M+Na-2H]- 175.08528 138.2
[M]+ 154.11006 129.8
[M]- 154.11116 129.8
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.