CID 75525019

Tert-butyl 2-{[1-(ethylcarbamoyl)piperidin-4-yl]amino}acetate

Structural Information

Molecular Formula
C14H27N3O3
SMILES
CCNC(=O)N1CCC(CC1)NCC(=O)OC(C)(C)C
InChI
InChI=1S/C14H27N3O3/c1-5-15-13(19)17-8-6-11(7-9-17)16-10-12(18)20-14(2,3)4/h11,16H,5-10H2,1-4H3,(H,15,19)
InChIKey
JJDOCBFQJUSZCI-UHFFFAOYSA-N
Compound name
tert-butyl 2-[[1-(ethylcarbamoyl)piperidin-4-yl]amino]acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

285.20523 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.21251 170.6
[M+Na]+ 308.19445 172.6
[M-H]- 284.19795 171.4
[M+NH4]+ 303.23905 184.3
[M+K]+ 324.16839 171.9
[M+H-H2O]+ 268.20249 163.2
[M+HCOO]- 330.20343 187.4
[M+CH3COO]- 344.21908 205.2
[M+Na-2H]- 306.17990 171.9
[M]+ 285.20468 168.3
[M]- 285.20578 168.3
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.