CID 83899855

Tert-butyl 3-(1-amino-2-hydroxyethyl)piperidine-1-carboxylate

Structural Information

Molecular Formula
C12H24N2O3
SMILES
CC(C)(C)OC(=O)N1CCCC(C1)C(CO)N
InChI
InChI=1S/C12H24N2O3/c1-12(2,3)17-11(16)14-6-4-5-9(7-14)10(13)8-15/h9-10,15H,4-8,13H2,1-3H3
InChIKey
UVECARAMUAMRTJ-UHFFFAOYSA-N
Compound name
tert-butyl 3-(1-amino-2-hydroxyethyl)piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

244.1787 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.18598 160.2
[M+Na]+ 267.16792 163.2
[M-H]- 243.17142 159.6
[M+NH4]+ 262.21252 175.1
[M+K]+ 283.14186 162.4
[M+H-H2O]+ 227.17596 153.9
[M+HCOO]- 289.17690 174.4
[M+CH3COO]- 303.19255 192.5
[M+Na-2H]- 265.15337 160.5
[M]+ 244.17815 155.9
[M]- 244.17925 155.9
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.