CID 61238944

Tert-butyl 3-(methylamino)-8-azabicyclo[3.2.1]octane-8-carboxylate

Structural Information

Molecular Formula
C13H24N2O2
SMILES
CC(C)(C)OC(=O)N1C2CCC1CC(C2)NC
InChI
InChI=1S/C13H24N2O2/c1-13(2,3)17-12(16)15-10-5-6-11(15)8-9(7-10)14-4/h9-11,14H,5-8H2,1-4H3
InChIKey
WVRGSCNPWBJQCH-UHFFFAOYSA-N
Compound name
tert-butyl 3-(methylamino)-8-azabicyclo[3.2.1]octane-8-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

240.18378 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.19106 159.8
[M+Na]+ 263.17300 164.5
[M-H]- 239.17650 160.6
[M+NH4]+ 258.21760 179.6
[M+K]+ 279.14694 163.1
[M+H-H2O]+ 223.18104 154.3
[M+HCOO]- 285.18198 175.3
[M+CH3COO]- 299.19763 195.7
[M+Na-2H]- 261.15845 162.4
[M]+ 240.18323 158.2
[M]- 240.18433 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