CID 328840

Nsc309390

Structural Information

Molecular Formula
C8H10N4O4
SMILES
CN1C(=O)C2(C(=O)N(C(=O)N2C)C)NC1=O
InChI
InChI=1S/C8H10N4O4/c1-10-4(13)8(9-6(10)15)5(14)11(2)7(16)12(8)3/h1-3H3,(H,9,15)
InChIKey
WMYFFLJPRCLOBL-UHFFFAOYSA-N
Compound name
1,3,8-trimethyl-1,3,6,8-tetrazaspiro[4.4]nonane-2,4,7,9-tetrone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

226.0702 Da
Monoisotopic Mass

-1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.077476 145.7
[M+Na]+ 249.059418 157.8
[M-H]- 225.062924 146.5
[M+NH4]+ 244.104023 164.4
[M+K]+ 265.033358 155.2
[M+H-H2O]+ 209.067460 140.2
[M+HCOO]- 271.068401 162.4
[M+CH3COO]- 285.084051 186.9
[M+Na-2H]- 247.044866 145.2
[M]+ 226.06965142 145.2
[M]- 226.07074858 145.2
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.