CID 129412031

(2r,3r)-1-[(tert-butoxy)carbonyl]-3-tert-butylpiperidine-2-carboxylic acid

Structural Information

Molecular Formula
C15H27NO4
SMILES
CC(C)(C)[C@H]1CCCN([C@H]1C(=O)O)C(=O)OC(C)(C)C
InChI
InChI=1S/C15H27NO4/c1-14(2,3)10-8-7-9-16(11(10)12(17)18)13(19)20-15(4,5)6/h10-11H,7-9H2,1-6H3,(H,17,18)/t10-,11+/m0/s1
InChIKey
QEAUYMGRKFUCBT-WDEREUQCSA-N
Compound name
(2R,3R)-3-tert-butyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

285.194 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.20128 167.8
[M+Na]+ 308.18322 174.6
[M+NH4]+ 303.22782 172.1
[M+K]+ 324.15716 173.0
[M-H]- 284.18672 164.9
[M+Na-2H]- 306.16867 168.1
[M]+ 285.19345 167.5
[M]- 285.19455 167.5
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.