CID 393261

Nsc694911

Structural Information

Molecular Formula
C14H15N3O3
SMILES
CC1=CN(C(=O)NC1=O)C2CCN(O2)C3=CC=CC=C3
InChI
InChI=1S/C14H15N3O3/c1-10-9-16(14(19)15-13(10)18)12-7-8-17(20-12)11-5-3-2-4-6-11/h2-6,9,12H,7-8H2,1H3,(H,15,18,19)
InChIKey
FHJNFUSPTLKOGR-UHFFFAOYSA-N
Compound name
5-methyl-1-(2-phenyl-1,2-oxazolidin-5-yl)pyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

273.11133 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.118606 160.9
[M+Na]+ 296.100548 170.5
[M-H]- 272.104054 166.8
[M+NH4]+ 291.145153 172.7
[M+K]+ 312.074488 166.3
[M+H-H2O]+ 256.108590 151.4
[M+HCOO]- 318.109531 179.0
[M+CH3COO]- 332.125181 172.4
[M+Na-2H]- 294.085996 163.5
[M]+ 273.11078142 160.0
[M]- 273.11187858 160.0
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.