CID 53407862

4-(piperidin-4-yloxy)-piperidine-1-carboxylic acid t-butyl ester

Structural Information

Molecular Formula
C15H28N2O3
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)OC2CCNCC2
InChI
InChI=1S/C15H28N2O3/c1-15(2,3)20-14(18)17-10-6-13(7-11-17)19-12-4-8-16-9-5-12/h12-13,16H,4-11H2,1-3H3
InChIKey
UTDIXFSPTJESFX-UHFFFAOYSA-N
Compound name
tert-butyl 4-piperidin-4-yloxypiperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

199
Patents

284.21 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.21728 172.0
[M+Na]+ 307.19922 172.9
[M-H]- 283.20272 172.4
[M+NH4]+ 302.24382 183.7
[M+K]+ 323.17316 171.1
[M+H-H2O]+ 267.20726 163.5
[M+HCOO]- 329.20820 181.4
[M+CH3COO]- 343.22385 195.8
[M+Na-2H]- 305.18467 172.1
[M]+ 284.20945 164.7
[M]- 284.21055 164.7
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