CID 125180940

Rac-tert-butyl n-[(2r,3s)-2-(piperidin-4-yl)oxan-3-yl]carbamate

Structural Information

Molecular Formula
C15H28N2O3
SMILES
CC(C)(C)OC(=O)N[C@H]1CCCO[C@@H]1C2CCNCC2
InChI
InChI=1S/C15H28N2O3/c1-15(2,3)20-14(18)17-12-5-4-10-19-13(12)11-6-8-16-9-7-11/h11-13,16H,4-10H2,1-3H3,(H,17,18)/t12-,13+/m0/s1
InChIKey
JDIUZRMDRWWAHL-QWHCGFSZSA-N
Compound name
tert-butyl N-[(2R,3S)-2-piperidin-4-yloxan-3-yl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.21 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.21728 170.8
[M+Na]+ 307.19922 171.0
[M-H]- 283.20272 173.2
[M+NH4]+ 302.24382 182.3
[M+K]+ 323.17316 170.2
[M+H-H2O]+ 267.20726 162.9
[M+HCOO]- 329.20820 181.8
[M+CH3COO]- 343.22385 198.3
[M+Na-2H]- 305.18467 172.3
[M]+ 284.20945 163.0
[M]- 284.21055 163.0
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.