CID 83912849

1779661-96-9

Structural Information

Molecular Formula
C12H24N2O3
SMILES
CC(C)(C)OC(=O)N1CCCC(C1)(COC)N
InChI
InChI=1S/C12H24N2O3/c1-11(2,3)17-10(15)14-7-5-6-12(13,8-14)9-16-4/h5-9,13H2,1-4H3
InChIKey
KUHHKDVIVODILL-UHFFFAOYSA-N
Compound name
tert-butyl 3-amino-3-(methoxymethyl)piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

244.1787 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.185976 158.8
[M+Na]+ 267.167918 163.4
[M-H]- 243.171424 159.8
[M+NH4]+ 262.212523 176.5
[M+K]+ 283.141858 163.3
[M+H-H2O]+ 227.175960 153.1
[M+HCOO]- 289.176901 175.5
[M+CH3COO]- 303.192551 193.5
[M+Na-2H]- 265.153366 162.1
[M]+ 244.17815142 157.3
[M]- 244.17924858 157.3
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.