CID 125449011

Benzyl 4,4-dimethoxy-3-oxopiperidine-1-carboxylate

Structural Information

Molecular Formula
C15H19NO5
SMILES
COC1(CCN(CC1=O)C(=O)OCC2=CC=CC=C2)OC
InChI
InChI=1S/C15H19NO5/c1-19-15(20-2)8-9-16(10-13(15)17)14(18)21-11-12-6-4-3-5-7-12/h3-7H,8-11H2,1-2H3
InChIKey
FIXGGAWNQKSLOZ-UHFFFAOYSA-N
Compound name
benzyl 4,4-dimethoxy-3-oxopiperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

293.1263 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.133576 165.7
[M+Na]+ 316.115518 171.5
[M-H]- 292.119024 170.5
[M+NH4]+ 311.160123 181.3
[M+K]+ 332.089458 170.6
[M+H-H2O]+ 276.123560 157.6
[M+HCOO]- 338.124501 184.5
[M+CH3COO]- 352.140151 198.8
[M+Na-2H]- 314.100966 169.2
[M]+ 293.12575142 167.5
[M]- 293.12684858 167.5
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.