CID 155973189

2648901-76-0

Structural Information

Molecular Formula
C9H15NO2
SMILES
C1C[C@H]2C[C@@H]([C@@](C1)(C2)N)C(=O)O
InChI
InChI=1S/C9H15NO2/c10-9-3-1-2-6(5-9)4-7(9)8(11)12/h6-7H,1-5,10H2,(H,11,12)/t6-,7+,9+/m0/s1
InChIKey
XRANVAXKBZDYFY-LKEWCRSYSA-N
Compound name
(1S,5R,6S)-5-aminobicyclo[3.2.1]octane-6-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

169.11028 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.11756 136.9
[M+Na]+ 192.09950 144.0
[M+NH4]+ 187.14410 146.8
[M+K]+ 208.07344 139.5
[M-H]- 168.10300 136.9
[M+Na-2H]- 190.08495 139.1
[M]+ 169.10973 137.6
[M]- 169.11083 137.6
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.