CID 165945962

1-azabicyclo[3.2.2]nonane-6-carboxylic acid hydrochloride

Structural Information

Molecular Formula
C9H15NO2
SMILES
C1CC2CCN(C1)CC2C(=O)O
InChI
InChI=1S/C9H15NO2/c11-9(12)8-6-10-4-1-2-7(8)3-5-10/h7-8H,1-6H2,(H,11,12)
InChIKey
HDDDTIJFNTYGTE-UHFFFAOYSA-N
Compound name
1-azabicyclo[3.2.2]nonane-6-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

169.11028 Da
Monoisotopic Mass

-1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.11756 142.2
[M+Na]+ 192.09950 149.4
[M-H]- 168.10300 141.7
[M+NH4]+ 187.14410 162.5
[M+K]+ 208.07344 147.3
[M+H-H2O]+ 152.10754 143.0
[M+HCOO]- 214.10848 151.8
[M+CH3COO]- 228.12413 151.9
[M+Na-2H]- 190.08495 151.4
[M]+ 169.10973 139.9
[M]- 169.11083 139.9
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.