CID 283449

Phenyl 1-piperidinecarboxylate

Structural Information

Molecular Formula
C12H15NO2
SMILES
C1CCN(CC1)C(=O)OC2=CC=CC=C2
InChI
InChI=1S/C12H15NO2/c14-12(13-9-5-2-6-10-13)15-11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10H2
InChIKey
GGZDLAOKPXEJCP-UHFFFAOYSA-N
Compound name
phenyl piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

9
References

226
Patents

205.11028 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.117556 145.8
[M+Na]+ 228.099498 150.2
[M-H]- 204.103004 150.0
[M+NH4]+ 223.144103 162.7
[M+K]+ 244.073438 148.3
[M+H-H2O]+ 188.107540 137.7
[M+HCOO]- 250.108481 164.9
[M+CH3COO]- 264.124131 182.4
[M+Na-2H]- 226.084946 150.8
[M]+ 205.10973142 141.7
[M]- 205.11082858 141.7
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