CID 137951966

Methyl 5,5-dimethoxypiperidine-3-carboxylate

Structural Information

Molecular Formula
C9H17NO4
SMILES
COC(=O)C1CC(CNC1)(OC)OC
InChI
InChI=1S/C9H17NO4/c1-12-8(11)7-4-9(13-2,14-3)6-10-5-7/h7,10H,4-6H2,1-3H3
InChIKey
RLGDWFWJPDOIIX-UHFFFAOYSA-N
Compound name
methyl 5,5-dimethoxypiperidine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

203.11575 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.12303 144.4
[M+Na]+ 226.10497 150.1
[M-H]- 202.10847 144.8
[M+NH4]+ 221.14957 163.4
[M+K]+ 242.07891 150.2
[M+H-H2O]+ 186.11301 138.9
[M+HCOO]- 248.11395 161.9
[M+CH3COO]- 262.12960 180.7
[M+Na-2H]- 224.09042 148.7
[M]+ 203.11520 143.9
[M]- 203.11630 143.9
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.