CID 16228666

6-azabicyclo[3.2.1]octane-5-carboxylic acid hydrochloride

Structural Information

Molecular Formula
C8H13NO2
SMILES
C1CC2CC(C1)(NC2)C(=O)O
InChI
InChI=1S/C8H13NO2/c10-7(11)8-3-1-2-6(4-8)5-9-8/h6,9H,1-5H2,(H,10,11)
InChIKey
JMZDITNNFGJZLT-UHFFFAOYSA-N
Compound name
6-azabicyclo[3.2.1]octane-5-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

155.09464 Da
Monoisotopic Mass

-1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.10192 134.8
[M+Na]+ 178.08386 140.3
[M-H]- 154.08736 133.0
[M+NH4]+ 173.12846 158.0
[M+K]+ 194.05780 137.9
[M+H-H2O]+ 138.09190 130.2
[M+HCOO]- 200.09284 149.5
[M+CH3COO]- 214.10849 169.4
[M+Na-2H]- 176.06931 140.0
[M]+ 155.09409 128.7
[M]- 155.09519 128.7
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