CID 2735646

1-(tert-butoxycarbonyl)piperidine-4-carboxamide

Structural Information

Molecular Formula
C11H20N2O3
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)C(=O)N
InChI
InChI=1S/C11H20N2O3/c1-11(2,3)16-10(15)13-6-4-8(5-7-13)9(12)14/h8H,4-7H2,1-3H3,(H2,12,14)
InChIKey
YHFUWPUJUMZXBD-UHFFFAOYSA-N
Compound name
tert-butyl 4-carbamoylpiperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

375
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

literature stripe

Patent stripe

patents stripe