CID 155973026

Methyl 4-ethyl-2-azabicyclo[2.1.1]hexane-1-carboxylate hydrochloride

Structural Information

Molecular Formula
C9H15NO2
SMILES
CCC12CC(C1)(NC2)C(=O)OC
InChI
InChI=1S/C9H15NO2/c1-3-8-4-9(5-8,10-6-8)7(11)12-2/h10H,3-6H2,1-2H3
InChIKey
GCXBACUIUJRJDQ-UHFFFAOYSA-N
Compound name
methyl 4-ethyl-2-azabicyclo[2.1.1]hexane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

169.11028 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.11756 135.9
[M+Na]+ 192.09950 138.3
[M+NH4]+ 187.14410 143.3
[M+K]+ 208.07344 135.6
[M-H]- 168.10300 129.6
[M+Na-2H]- 190.08495 133.7
[M]+ 169.10973 133.2
[M]- 169.11083 133.2
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

No patent data available for this compound.