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]+ 212.128126 147.1
[M+Na]+ 234.110068 151.9
[M-H]- 210.113574 146.2
[M+NH4]+ 229.154673 165.3
[M+K]+ 250.084008 149.6
[M+H-H2O]+ 194.118110 141.1
[M+HCOO]- 256.119051 160.5
[M+CH3COO]- 270.134701 184.9
[M+Na-2H]- 232.095516 150.5
[M]+ 211.12030142 142.9
[M]- 211.12139858 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.