CID 139594652

Dtxsid201028728

Structural Information

Molecular Formula
C14H17NO5
SMILES
CCOC1=C(C=C(C=C1)N2C(=O)C(OC2=O)C)OCC
InChI
InChI=1S/C14H17NO5/c1-4-18-11-7-6-10(8-12(11)19-5-2)15-13(16)9(3)20-14(15)17/h6-9H,4-5H2,1-3H3
InChIKey
CYUKLOPUJKXNNS-UHFFFAOYSA-N
Compound name
3-(3,4-diethoxyphenyl)-5-methyl-1,3-oxazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

0
Patents

279.1107 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 280.11798 160.0
[M+Na]+ 302.09992 169.3
[M-H]- 278.10342 166.7
[M+NH4]+ 297.14452 175.7
[M+K]+ 318.07386 168.4
[M+H-H2O]+ 262.10796 153.0
[M+HCOO]- 324.10890 181.4
[M+CH3COO]- 338.12455 200.1
[M+Na-2H]- 300.08537 161.3
[M]+ 279.11015 165.9
[M]- 279.11125 165.9
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

No patent data available for this compound.