CID 155820044

2470438-98-1

Structural Information

Molecular Formula
C11H17NO3
SMILES
CCOC(=O)C1CC2CNCC(C1)C2=O
InChI
InChI=1S/C11H17NO3/c1-2-15-11(14)7-3-8-5-12-6-9(4-7)10(8)13/h7-9,12H,2-6H2,1H3
InChIKey
WLVIIWGOWCKGSL-UHFFFAOYSA-N
Compound name
ethyl 9-oxo-3-azabicyclo[3.3.1]nonane-7-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

211.12085 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.12813 147.1
[M+Na]+ 234.11007 151.9
[M-H]- 210.11357 146.2
[M+NH4]+ 229.15467 165.3
[M+K]+ 250.08401 149.6
[M+H-H2O]+ 194.11811 141.1
[M+HCOO]- 256.11905 160.5
[M+CH3COO]- 270.13470 184.9
[M+Na-2H]- 232.09552 150.5
[M]+ 211.12030 142.9
[M]- 211.12140 142.9
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.