CID 131612543

2247103-57-5

Structural Information

Molecular Formula
C6H9N3O2
SMILES
C1C(CC12C(=O)NC(=O)N2)N
InChI
InChI=1S/C6H9N3O2/c7-3-1-6(2-3)4(10)8-5(11)9-6/h3H,1-2,7H2,(H2,8,9,10,11)
InChIKey
CADLFISNRFZXEJ-UHFFFAOYSA-N
Compound name
2-amino-5,7-diazaspiro[3.4]octane-6,8-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.06947 Da
Monoisotopic Mass

-1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.07675 131.9
[M+Na]+ 178.05869 138.3
[M-H]- 154.06219 132.1
[M+NH4]+ 173.10329 145.8
[M+K]+ 194.03263 138.2
[M+H-H2O]+ 138.06673 121.4
[M+HCOO]- 200.06767 148.9
[M+CH3COO]- 214.08332 174.1
[M+Na-2H]- 176.04414 135.3
[M]+ 155.06892 133.2
[M]- 155.07002 133.2
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.