CID 10704905

Benzyl 2-hydroxypiperidine-1-carboxylate

Structural Information

Molecular Formula
C13H17NO3
SMILES
C1CCN(C(C1)O)C(=O)OCC2=CC=CC=C2
InChI
InChI=1S/C13H17NO3/c15-12-8-4-5-9-14(12)13(16)17-10-11-6-2-1-3-7-11/h1-3,6-7,12,15H,4-5,8-10H2
InChIKey
DJHBQZYPXJJJMZ-UHFFFAOYSA-N
Compound name
benzyl 2-hydroxypiperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

235.12085 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.12813 154.3
[M+Na]+ 258.11007 165.6
[M+NH4]+ 253.15467 161.7
[M+K]+ 274.08401 159.7
[M-H]- 234.11357 156.6
[M+Na-2H]- 256.09552 160.5
[M]+ 235.12030 156.3
[M]- 235.12140 156.3
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