CID 138987695

Rac-tert-butyl n-{[(3r,5r)-5-tert-butylpiperidin-3-yl]methyl}carbamate

Structural Information

Molecular Formula
C15H30N2O2
SMILES
CC(C)(C)[C@@H]1C[C@@H](CNC1)CNC(=O)OC(C)(C)C
InChI
InChI=1S/C15H30N2O2/c1-14(2,3)12-7-11(8-16-10-12)9-17-13(18)19-15(4,5)6/h11-12,16H,7-10H2,1-6H3,(H,17,18)/t11-,12+/m0/s1
InChIKey
KBZLSHIPCFHITN-NWDGAFQWSA-N
Compound name
tert-butyl N-[[(3S,5S)-5-tert-butylpiperidin-3-yl]methyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

270.23074 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.23802 169.9
[M+Na]+ 293.21996 172.5
[M-H]- 269.22346 169.5
[M+NH4]+ 288.26456 184.3
[M+K]+ 309.19390 170.7
[M+H-H2O]+ 253.22800 163.8
[M+HCOO]- 315.22894 182.9
[M+CH3COO]- 329.24459 198.9
[M+Na-2H]- 291.20541 171.8
[M]+ 270.23019 166.3
[M]- 270.23129 166.3
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.