CID 71474579

(2s,5r)-5-((benzyloxy)amino)piperidine-2-carboxamide

Structural Information

Molecular Formula
C13H19N3O2
SMILES
C1C[C@H](NC[C@@H]1NOCC2=CC=CC=C2)C(=O)N
InChI
InChI=1S/C13H19N3O2/c14-13(17)12-7-6-11(8-15-12)16-18-9-10-4-2-1-3-5-10/h1-5,11-12,15-16H,6-9H2,(H2,14,17)/t11-,12+/m1/s1
InChIKey
OWIVQKMLPQEEGV-NEPJUHHUSA-N
Compound name
(2S,5R)-5-(phenylmethoxyamino)piperidine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

74
Patents

249.14772 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.15500 156.4
[M+Na]+ 272.13694 159.0
[M-H]- 248.14044 158.7
[M+NH4]+ 267.18154 169.9
[M+K]+ 288.11088 155.5
[M+H-H2O]+ 232.14498 147.8
[M+HCOO]- 294.14592 175.0
[M+CH3COO]- 308.16157 195.0
[M+Na-2H]- 270.12239 159.7
[M]+ 249.14717 149.0
[M]- 249.14827 149.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe