CID 216929

37874-20-7

Structural Information

Molecular Formula
C9H13N3O2
SMILES
C1CN2CCC1C3(C2)C(=O)NC(=O)N3
InChI
InChI=1S/C9H13N3O2/c13-7-9(11-8(14)10-7)5-12-3-1-6(9)2-4-12/h6H,1-5H2,(H2,10,11,13,14)
InChIKey
IKRSGHMLOHITNH-UHFFFAOYSA-N
Compound name
spiro[1-azabicyclo[2.2.2]octane-3,5'-imidazolidine]-2',4'-dione
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

3
Patents

195.10077 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.10805 141.2
[M+Na]+ 218.08999 146.7
[M-H]- 194.09349 134.3
[M+NH4]+ 213.13459 163.3
[M+K]+ 234.06393 142.7
[M+H-H2O]+ 178.09803 134.7
[M+HCOO]- 240.09897 147.0
[M+CH3COO]- 254.11462 150.1
[M+Na-2H]- 216.07544 149.4
[M]+ 195.10022 137.0
[M]- 195.10132 137.0
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

patents stripe