CID 98380

67196-39-8

Structural Information

Molecular Formula
C10H12N2O3
SMILES
CC1CC=CCC12C(=O)NC(=O)NC2=O
InChI
InChI=1S/C10H12N2O3/c1-6-4-2-3-5-10(6)7(13)11-9(15)12-8(10)14/h2-3,6H,4-5H2,1H3,(H2,11,12,13,14,15)
InChIKey
BIENPBAKZMWQKT-UHFFFAOYSA-N
Compound name
11-methyl-2,4-diazaspiro[5.5]undec-8-ene-1,3,5-trione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

208.0848 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.092076 145.5
[M+Na]+ 231.074018 153.1
[M-H]- 207.077524 145.7
[M+NH4]+ 226.118623 162.6
[M+K]+ 247.047958 149.1
[M+H-H2O]+ 191.082060 139.0
[M+HCOO]- 253.083001 159.5
[M+CH3COO]- 267.098651 179.3
[M+Na-2H]- 229.059466 149.4
[M]+ 208.08425142 137.9
[M]- 208.08534858 137.9
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.