CID 167739951

Tert-butyl n-{[(2r)-6-oxopiperidin-2-yl]methyl}carbamate

Structural Information

Molecular Formula
C11H20N2O3
SMILES
CC(C)(C)OC(=O)NC[C@H]1CCCC(=O)N1
InChI
InChI=1S/C11H20N2O3/c1-11(2,3)16-10(15)12-7-8-5-4-6-9(14)13-8/h8H,4-7H2,1-3H3,(H,12,15)(H,13,14)/t8-/m1/s1
InChIKey
WMKHQNBBBFMHBU-MRVPVSSYSA-N
Compound name
tert-butyl N-[[(2R)-6-oxopiperidin-2-yl]methyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

228.1474 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.154676 154.2
[M+Na]+ 251.136618 158.1
[M-H]- 227.140124 154.2
[M+NH4]+ 246.181223 169.9
[M+K]+ 267.110558 156.7
[M+H-H2O]+ 211.144660 147.9
[M+HCOO]- 273.145601 170.5
[M+CH3COO]- 287.161251 188.2
[M+Na-2H]- 249.122066 157.2
[M]+ 228.14685142 150.4
[M]- 228.14794858 150.4
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.