CID 392870

124443-68-1

Structural Information

Molecular Formula
C12H21NO4
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)C(=O)OC
InChI
InChI=1S/C12H21NO4/c1-12(2,3)17-11(15)13-7-5-9(6-8-13)10(14)16-4/h9H,5-8H2,1-4H3
InChIKey
PTZNCCIULVXFIJ-UHFFFAOYSA-N
Compound name
1-O-tert-butyl 4-O-methyl piperidine-1,4-dicarboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1227
Patents

243.14706 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.15434 156.1
[M+Na]+ 266.13628 164.1
[M+NH4]+ 261.18088 161.6
[M+K]+ 282.11022 161.3
[M-H]- 242.13978 154.4
[M+Na-2H]- 264.12173 158.0
[M]+ 243.14651 156.4
[M]- 243.14761 156.4
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