CID 138017819

2241140-44-1

Structural Information

Molecular Formula
C10H14N2O2
SMILES
C1CCC23CNCC2(C1)C(=O)NC3=O
InChI
InChI=1S/C10H14N2O2/c13-7-9-3-1-2-4-10(9,6-11-5-9)8(14)12-7/h11H,1-6H2,(H,12,13,14)
InChIKey
UASSYCJJPPEFTB-UHFFFAOYSA-N
Compound name
8,11-diazatricyclo[4.3.3.01,6]dodecane-7,9-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.10553 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.11281 145.4
[M+Na]+ 217.09475 152.8
[M+NH4]+ 212.13935 155.7
[M+K]+ 233.06869 147.9
[M-H]- 193.09825 145.0
[M+Na-2H]- 215.08020 149.5
[M]+ 194.10498 146.1
[M]- 194.10608 146.1
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.