CID 3063447

100907-71-9

Structural Information

Molecular Formula
C12H12N2O3
SMILES
CC(C)N1C(=O)C(=O)N(C1=O)C2=CC=CC=C2
InChI
InChI=1S/C12H12N2O3/c1-8(2)13-10(15)11(16)14(12(13)17)9-6-4-3-5-7-9/h3-8H,1-2H3
InChIKey
RSEIWDRCEDSVQX-UHFFFAOYSA-N
Compound name
1-phenyl-3-propan-2-ylimidazolidine-2,4,5-trione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

232.0848 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.092076 148.9
[M+Na]+ 255.074018 158.3
[M-H]- 231.077524 153.7
[M+NH4]+ 250.118623 166.1
[M+K]+ 271.047958 155.6
[M+H-H2O]+ 215.082060 141.5
[M+HCOO]- 277.083001 169.4
[M+CH3COO]- 291.098651 191.2
[M+Na-2H]- 253.059466 149.6
[M]+ 232.08425142 149.4
[M]- 232.08534858 149.4
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.