CID 10679562

59234-46-7

Structural Information

Molecular Formula
C9H15NO4
SMILES
COC(=O)[C@H]1CCC[C@H](N1)C(=O)OC
InChI
InChI=1S/C9H15NO4/c1-13-8(11)6-4-3-5-7(10-6)9(12)14-2/h6-7,10H,3-5H2,1-2H3/t6-,7+
InChIKey
DTBPRDQEECCDNY-KNVOCYPGSA-N
Compound name
dimethyl (2S,6R)-piperidine-2,6-dicarboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

31
Patents

201.10011 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.10739 143.9
[M+Na]+ 224.08933 148.8
[M-H]- 200.09283 144.0
[M+NH4]+ 219.13393 160.8
[M+K]+ 240.06327 148.4
[M+H-H2O]+ 184.09737 137.6
[M+HCOO]- 246.09831 160.6
[M+CH3COO]- 260.11396 180.5
[M+Na-2H]- 222.07478 145.6
[M]+ 201.09956 141.5
[M]- 201.10066 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

literature stripe

Patent stripe

patents stripe