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

26
Patents

240.18378 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.191056 159.8
[M+Na]+ 263.172998 164.5
[M-H]- 239.176504 160.6
[M+NH4]+ 258.217603 179.6
[M+K]+ 279.146938 163.1
[M+H-H2O]+ 223.181040 154.3
[M+HCOO]- 285.181981 175.3
[M+CH3COO]- 299.197631 195.7
[M+Na-2H]- 261.158446 162.4
[M]+ 240.18323142 158.2
[M]- 240.18432858 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