CID 11011289

Methyl n-cbz-piperidine-2-carboxylate

Structural Information

Molecular Formula
C15H19NO4
SMILES
COC(=O)C1CCCCN1C(=O)OCC2=CC=CC=C2
InChI
InChI=1S/C15H19NO4/c1-19-14(17)13-9-5-6-10-16(13)15(18)20-11-12-7-3-2-4-8-12/h2-4,7-8,13H,5-6,9-11H2,1H3
InChIKey
PKYPKDMELOKLKL-UHFFFAOYSA-N
Compound name
1-O-benzyl 2-O-methyl piperidine-1,2-dicarboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

38
Patents

277.1314 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.13868 163.9
[M+Na]+ 300.12062 167.8
[M-H]- 276.12412 168.1
[M+NH4]+ 295.16522 177.9
[M+K]+ 316.09456 166.3
[M+H-H2O]+ 260.12866 155.2
[M+HCOO]- 322.12960 181.5
[M+CH3COO]- 336.14525 196.1
[M+Na-2H]- 298.10607 165.5
[M]+ 277.13085 162.7
[M]- 277.13195 162.7
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