CID 357727

130250-54-3

Structural Information

Molecular Formula
C13H23NO4
SMILES
CCOC(=O)C1CCCN(C1)C(=O)OC(C)(C)C
InChI
InChI=1S/C13H23NO4/c1-5-17-11(15)10-7-6-8-14(9-10)12(16)18-13(2,3)4/h10H,5-9H2,1-4H3
InChIKey
YCXCRFGBFZTUSU-UHFFFAOYSA-N
Compound name
1-O-tert-butyl 3-O-ethyl piperidine-1,3-dicarboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

515
Patents

257.16272 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.17000 160.5
[M+Na]+ 280.15194 168.2
[M+NH4]+ 275.19654 165.7
[M+K]+ 296.12588 165.2
[M-H]- 256.15544 158.7
[M+Na-2H]- 278.13739 162.0
[M]+ 257.16217 160.6
[M]- 257.16327 160.6
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