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]+ 315.22783 177.1
[M+Na]+ 337.20977 178.7
[M-H]- 313.21327 177.9
[M+NH4]+ 332.25437 189.9
[M+K]+ 353.18371 179.3
[M+H-H2O]+ 297.21781 170.2
[M+HCOO]- 359.21875 190.6
[M+CH3COO]- 373.23440 210.0
[M+Na-2H]- 335.19522 175.0
[M]+ 314.22000 176.6
[M]- 314.22110 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.