CID 137942578

2168794-27-0

Structural Information

Molecular Formula
C13H24N2O2
SMILES
CC(C)(C)OC(=O)N1CC2(CCC1CC2)CN
InChI
InChI=1S/C13H24N2O2/c1-12(2,3)17-11(16)15-9-13(8-14)6-4-10(15)5-7-13/h10H,4-9,14H2,1-3H3
InChIKey
BZMYCGMSOPRMNR-UHFFFAOYSA-N
Compound name
tert-butyl 4-(aminomethyl)-2-azabicyclo[2.2.2]octane-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.18378 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.19106 155.4
[M+Na]+ 263.17300 162.4
[M+NH4]+ 258.21760 165.5
[M+K]+ 279.14694 155.5
[M-H]- 239.17650 151.9
[M+Na-2H]- 261.15845 153.0
[M]+ 240.18323 155.3
[M]- 240.18433 155.3
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.