CID 14387499

2751603-05-9

Structural Information

Molecular Formula
C13H18N2O
SMILES
C1CCN(CC1)C(=O)[C@@H](C2=CC=CC=C2)N
InChI
InChI=1S/C13H18N2O/c14-12(11-7-3-1-4-8-11)13(16)15-9-5-2-6-10-15/h1,3-4,7-8,12H,2,5-6,9-10,14H2/t12-/m1/s1
InChIKey
LBYPZAJJZOBPHA-GFCCVEGCSA-N
Compound name
(2R)-2-amino-2-phenyl-1-piperidin-1-ylethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

218.1419 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.149176 151.3
[M+Na]+ 241.131118 154.1
[M-H]- 217.134624 154.8
[M+NH4]+ 236.175723 166.9
[M+K]+ 257.105058 151.4
[M+H-H2O]+ 201.139160 143.0
[M+HCOO]- 263.140101 169.2
[M+CH3COO]- 277.155751 189.1
[M+Na-2H]- 239.116566 153.9
[M]+ 218.14135142 143.9
[M]- 218.14244858 143.9
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.