CID 45791700

Tert-butyl 4-[(1-methoxy-3-methyl-1-oxobutan-2-yl)amino]piperidine-1-carboxylate

Structural Information

Molecular Formula
C16H30N2O4
SMILES
CC(C)C(C(=O)OC)NC1CCN(CC1)C(=O)OC(C)(C)C
InChI
InChI=1S/C16H30N2O4/c1-11(2)13(14(19)21-6)17-12-7-9-18(10-8-12)15(20)22-16(3,4)5/h11-13,17H,7-10H2,1-6H3
InChIKey
ZAHCOLUHCNSWJD-UHFFFAOYSA-N
Compound name
tert-butyl 4-[(1-methoxy-3-methyl-1-oxobutan-2-yl)amino]piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

314.22055 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 315.227826 177.1
[M+Na]+ 337.209768 178.7
[M-H]- 313.213274 177.9
[M+NH4]+ 332.254373 189.9
[M+K]+ 353.183708 179.3
[M+H-H2O]+ 297.217810 170.2
[M+HCOO]- 359.218751 190.6
[M+CH3COO]- 373.234401 210.0
[M+Na-2H]- 335.195216 175.0
[M]+ 314.22000142 176.6
[M]- 314.22109858 176.6
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

No patent data available for this compound.