CID 14188

1097-57-0

Structural Information

Molecular Formula
C18H16N2O4
SMILES
CCOC(=O)N1C(=O)C(NC1=O)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C18H16N2O4/c1-2-24-17(23)20-15(21)18(19-16(20)22,13-9-5-3-6-10-13)14-11-7-4-8-12-14/h3-12H,2H2,1H3,(H,19,22)
InChIKey
WAOIWRAOVPQJKC-UHFFFAOYSA-N
Compound name
ethyl 2,5-dioxo-4,4-diphenylimidazolidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

324.111 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.11828 174.4
[M+Na]+ 347.10022 182.0
[M-H]- 323.10372 180.6
[M+NH4]+ 342.14482 188.3
[M+K]+ 363.07416 177.4
[M+H-H2O]+ 307.10826 165.4
[M+HCOO]- 369.10920 193.0
[M+CH3COO]- 383.12485 201.9
[M+Na-2H]- 345.08567 175.7
[M]+ 324.11045 173.7
[M]- 324.11155 173.7
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