CID 65813971

2361643-41-4

Structural Information

Molecular Formula
C9H15NO4
SMILES
COC(=O)C1(CCNCC1)C(=O)OC
InChI
InChI=1S/C9H15NO4/c1-13-7(11)9(8(12)14-2)3-5-10-6-4-9/h10H,3-6H2,1-2H3
InChIKey
HTFKGBZWPKAKEX-UHFFFAOYSA-N
Compound name
dimethyl piperidine-4,4-dicarboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

40
Patents

201.10011 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.107386 144.2
[M+Na]+ 224.089328 149.1
[M-H]- 200.092834 144.3
[M+NH4]+ 219.133933 162.8
[M+K]+ 240.063268 149.1
[M+H-H2O]+ 184.097370 138.7
[M+HCOO]- 246.098311 161.0
[M+CH3COO]- 260.113961 178.8
[M+Na-2H]- 222.074776 147.9
[M]+ 201.09956142 141.8
[M]- 201.10065858 141.8
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