CID 165750926

2803862-88-4

Structural Information

Molecular Formula
C8H11NO3
SMILES
C1CC2(CC1C(=O)NC2)C(=O)O
InChI
InChI=1S/C8H11NO3/c10-6-5-1-2-8(3-5,4-9-6)7(11)12/h5H,1-4H2,(H,9,10)(H,11,12)
InChIKey
WJNXPFKWKJAQSM-UHFFFAOYSA-N
Compound name
4-oxo-3-azabicyclo[3.2.1]octane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

169.0739 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.08118 136.5
[M+Na]+ 192.06312 144.2
[M+NH4]+ 187.10772 145.2
[M+K]+ 208.03706 140.3
[M-H]- 168.06662 134.3
[M+Na-2H]- 190.04857 138.0
[M]+ 169.07335 136.6
[M]- 169.07445 136.6
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.