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]+ 233.09208 148.9
[M+Na]+ 255.07402 158.3
[M-H]- 231.07752 153.7
[M+NH4]+ 250.11862 166.1
[M+K]+ 271.04796 155.6
[M+H-H2O]+ 215.08206 141.5
[M+HCOO]- 277.08300 169.4
[M+CH3COO]- 291.09865 191.2
[M+Na-2H]- 253.05947 149.6
[M]+ 232.08425 149.4
[M]- 232.08535 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.