CID 14661895

3-carbamoyl-piperidine-1-carboxylic acid tert-butyl ester

Structural Information

Molecular Formula
C11H20N2O3
SMILES
CC(C)(C)OC(=O)N1CCCC(C1)C(=O)N
InChI
InChI=1S/C11H20N2O3/c1-11(2,3)16-10(15)13-6-4-5-8(7-13)9(12)14/h8H,4-7H2,1-3H3,(H2,12,14)
InChIKey
APFUDGDIIFSTSD-UHFFFAOYSA-N
Compound name
tert-butyl 3-carbamoylpiperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

142
Patents

228.1474 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.15468 153.7
[M+Na]+ 251.13662 157.8
[M-H]- 227.14012 154.6
[M+NH4]+ 246.18122 169.8
[M+K]+ 267.11056 157.5
[M+H-H2O]+ 211.14466 147.4
[M+HCOO]- 273.14560 169.9
[M+CH3COO]- 287.16125 191.0
[M+Na-2H]- 249.12207 155.0
[M]+ 228.14685 150.1
[M]- 228.14795 150.1
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

patents stripe