CID 50938598

3-amino-1-phenylpiperidin-2-one

Structural Information

Molecular Formula
C11H14N2O
SMILES
C1CC(C(=O)N(C1)C2=CC=CC=C2)N
InChI
InChI=1S/C11H14N2O/c12-10-7-4-8-13(11(10)14)9-5-2-1-3-6-9/h1-3,5-6,10H,4,7-8,12H2
InChIKey
XYZGJLDFMCEELX-UHFFFAOYSA-N
Compound name
3-amino-1-phenylpiperidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

27
Patents

190.11061 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.11789 141.6
[M+Na]+ 213.09983 147.8
[M-H]- 189.10333 146.1
[M+NH4]+ 208.14443 159.2
[M+K]+ 229.07377 144.6
[M+H-H2O]+ 173.10787 133.9
[M+HCOO]- 235.10881 162.3
[M+CH3COO]- 249.12446 184.3
[M+Na-2H]- 211.08528 146.3
[M]+ 190.11006 135.7
[M]- 190.11116 135.7
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