CID 6618886

1-(ethoxycarbonyl)-4-piperidinecarboxylic acid

Structural Information

Molecular Formula
C9H15NO4
SMILES
CCOC(=O)N1CCC(CC1)C(=O)O
InChI
InChI=1S/C9H15NO4/c1-2-14-9(13)10-5-3-7(4-6-10)8(11)12/h7H,2-6H2,1H3,(H,11,12)
InChIKey
BVEBMPFJSMEGJX-UHFFFAOYSA-N
Compound name
1-ethoxycarbonylpiperidine-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

60
Patents

201.10011 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.107386 143.9
[M+Na]+ 224.089328 148.8
[M-H]- 200.092834 144.0
[M+NH4]+ 219.133933 160.8
[M+K]+ 240.063268 148.4
[M+H-H2O]+ 184.097370 137.6
[M+HCOO]- 246.098311 160.6
[M+CH3COO]- 260.113961 180.5
[M+Na-2H]- 222.074776 145.6
[M]+ 201.09956142 141.5
[M]- 201.10065858 141.5
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

patents stripe