CID 43840157

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

Structural Information

Molecular Formula
C8H12N2O2
SMILES
CN1C(=O)NC(=O)C12CCCC2
InChI
InChI=1S/C8H12N2O2/c1-10-7(12)9-6(11)8(10)4-2-3-5-8/h2-5H2,1H3,(H,9,11,12)
InChIKey
NWIWGGCNGWUUQU-UHFFFAOYSA-N
Compound name
1-methyl-1,3-diazaspiro[4.4]nonane-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

168.08987 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.097146 136.3
[M+Na]+ 191.079088 144.6
[M-H]- 167.082594 138.2
[M+NH4]+ 186.123693 159.2
[M+K]+ 207.053028 142.3
[M+H-H2O]+ 151.087130 130.6
[M+HCOO]- 213.088071 155.0
[M+CH3COO]- 227.103721 173.1
[M+Na-2H]- 189.064536 138.2
[M]+ 168.08932142 131.5
[M]- 168.09041858 131.5
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