CID 115735

2,4-oxazolidinedione, 5-ethyl-5-phenyl-, sodium salt

Structural Information

Molecular Formula
C11H11NO3
SMILES
CCC1(C(=O)NC(=O)O1)C2=CC=CC=C2
InChI
InChI=1S/C11H11NO3/c1-2-11(8-6-4-3-5-7-8)9(13)12-10(14)15-11/h3-7H,2H2,1H3,(H,12,13,14)
InChIKey
SGQOVJBGRJMVJR-UHFFFAOYSA-N
Compound name
5-ethyl-5-phenyl-1,3-oxazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

2
Patents

205.0739 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.081176 141.5
[M+Na]+ 228.063118 150.3
[M-H]- 204.066624 146.7
[M+NH4]+ 223.107723 160.9
[M+K]+ 244.037058 148.3
[M+H-H2O]+ 188.071160 135.6
[M+HCOO]- 250.072101 162.2
[M+CH3COO]- 264.087751 179.9
[M+Na-2H]- 226.048566 147.0
[M]+ 205.07335142 140.8
[M]- 205.07444858 140.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe