CID 146152347

2649060-95-5

Structural Information

Molecular Formula
C9H13NO2
SMILES
C1CC2C3C2(C(C1C3)N)C(=O)O
InChI
InChI=1S/C9H13NO2/c10-7-4-1-2-5-6(3-4)9(5,7)8(11)12/h4-7H,1-3,10H2,(H,11,12)
InChIKey
JAHACIXNYQSMGB-UHFFFAOYSA-N
Compound name
8-aminotricyclo[3.2.1.02,7]octane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

167.09464 Da
Monoisotopic Mass

-1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.10192 134.9
[M+Na]+ 190.08386 143.1
[M-H]- 166.08736 133.8
[M+NH4]+ 185.12846 157.6
[M+K]+ 206.05780 138.8
[M+H-H2O]+ 150.09190 131.7
[M+HCOO]- 212.09284 146.6
[M+CH3COO]- 226.10849 146.3
[M+Na-2H]- 188.06931 143.6
[M]+ 167.09409 138.8
[M]- 167.09519 138.8
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.