CID 94745

1,3-diazaspiro[4.4]nonane-2,4-dione

Structural Information

Molecular Formula
C7H10N2O2
SMILES
C1CCC2(C1)C(=O)NC(=O)N2
InChI
InChI=1S/C7H10N2O2/c10-5-7(3-1-2-4-7)9-6(11)8-5/h1-4H2,(H2,8,9,10,11)
InChIKey
JTTFXYHJDZZDQK-UHFFFAOYSA-N
Compound name
1,3-diazaspiro[4.4]nonane-2,4-dione
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

7
References

158
Patents

154.07423 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.081506 133.5
[M+Na]+ 177.063448 140.9
[M-H]- 153.066954 133.8
[M+NH4]+ 172.108053 155.9
[M+K]+ 193.037388 138.0
[M+H-H2O]+ 137.071490 127.7
[M+HCOO]- 199.072431 151.0
[M+CH3COO]- 213.088081 166.4
[M+Na-2H]- 175.048896 136.0
[M]+ 154.07368142 126.1
[M]- 154.07477858 126.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe