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]+ 229.15468 154.2
[M+Na]+ 251.13662 158.1
[M-H]- 227.14012 154.2
[M+NH4]+ 246.18122 169.9
[M+K]+ 267.11056 156.7
[M+H-H2O]+ 211.14466 147.9
[M+HCOO]- 273.14560 170.5
[M+CH3COO]- 287.16125 188.2
[M+Na-2H]- 249.12207 157.2
[M]+ 228.14685 150.4
[M]- 228.14795 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.