CID 121604716

Methyl 6-azabicyclo[3.2.1]octane-1-carboxylate hydrochloride

Structural Information

Molecular Formula
C9H15NO2
SMILES
COC(=O)C12CCCC(C1)NC2
InChI
InChI=1S/C9H15NO2/c1-12-8(11)9-4-2-3-7(5-9)10-6-9/h7,10H,2-6H2,1H3
InChIKey
MVMXTIHHRAUPSM-UHFFFAOYSA-N
Compound name
methyl 6-azabicyclo[3.2.1]octane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

169.11028 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.11756 139.1
[M+Na]+ 192.09950 147.3
[M+NH4]+ 187.14410 148.9
[M+K]+ 208.07344 142.1
[M-H]- 168.10300 138.2
[M+Na-2H]- 190.08495 141.7
[M]+ 169.10973 139.8
[M]- 169.11083 139.8
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.