CID 115550

Sodium 1,2,4-trimethyl-7,9-diazaspiro(4.5)decane-6,8,10-trione

Structural Information

Molecular Formula
C11H16N2O3
SMILES
CC1CC(C2(C1C)C(=O)NC(=O)NC2=O)C
InChI
InChI=1S/C11H16N2O3/c1-5-4-6(2)11(7(5)3)8(14)12-10(16)13-9(11)15/h5-7H,4H2,1-3H3,(H2,12,13,14,15,16)
InChIKey
LBXZCCGEUNGDSM-UHFFFAOYSA-N
Compound name
1,3,4-trimethyl-7,9-diazaspiro[4.5]decane-6,8,10-trione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

224.11609 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.12337 149.9
[M+Na]+ 247.10531 158.8
[M-H]- 223.10881 150.7
[M+NH4]+ 242.14991 168.9
[M+K]+ 263.07925 154.6
[M+H-H2O]+ 207.11335 144.7
[M+HCOO]- 269.11429 164.3
[M+CH3COO]- 283.12994 184.8
[M+Na-2H]- 245.09076 149.7
[M]+ 224.11554 144.2
[M]- 224.11664 144.2
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.