CID 266002

2,3,4-triphenyl-1,2,4-oxadiazolidin-5-one

Structural Information

Molecular Formula
C20H16N2O2
SMILES
C1=CC=C(C=C1)C2N(C(=O)ON2C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C20H16N2O2/c23-20-21(17-12-6-2-7-13-17)19(16-10-4-1-5-11-16)22(24-20)18-14-8-3-9-15-18/h1-15,19H
InChIKey
HAPZNYGVYRMXGW-UHFFFAOYSA-N
Compound name
2,3,4-triphenyl-1,2,4-oxadiazolidin-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

316.1212 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 317.12848 173.9
[M+Na]+ 339.11042 181.4
[M-H]- 315.11392 184.6
[M+NH4]+ 334.15502 185.0
[M+K]+ 355.08436 176.5
[M+H-H2O]+ 299.11846 163.0
[M+HCOO]- 361.11940 193.6
[M+CH3COO]- 375.13505 184.9
[M+Na-2H]- 337.09587 176.6
[M]+ 316.12065 172.4
[M]- 316.12175 172.4
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