CID 22708830

Refchem:893803

Structural Information

Molecular Formula
C12H24N2O3
SMILES
CC(C)(C)OC(=O)N1CCC(C(C1)OC)CN
InChI
InChI=1S/C12H24N2O3/c1-12(2,3)17-11(15)14-6-5-9(7-13)10(8-14)16-4/h9-10H,5-8,13H2,1-4H3
InChIKey
WXQMQAMXMZTBAB-UHFFFAOYSA-N
Compound name
tert-butyl 4-(aminomethyl)-3-methoxypiperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

244.1787 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.18598 159.6
[M+Na]+ 267.16792 164.3
[M-H]- 243.17142 160.7
[M+NH4]+ 262.21252 175.6
[M+K]+ 283.14186 163.8
[M+H-H2O]+ 227.17596 153.2
[M+HCOO]- 289.17690 176.3
[M+CH3COO]- 303.19255 195.3
[M+Na-2H]- 265.15337 160.9
[M]+ 244.17815 158.2
[M]- 244.17925 158.2
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