CID 122686

Dup 721

Structural Information

Molecular Formula
C14H16N2O4
SMILES
CC(=O)C1=CC=C(C=C1)N2CC(OC2=O)CNC(=O)C
InChI
InChI=1S/C14H16N2O4/c1-9(17)11-3-5-12(6-4-11)16-8-13(20-14(16)19)7-15-10(2)18/h3-6,13H,7-8H2,1-2H3,(H,15,18)
InChIKey
POXUJOYUVLWPQN-UHFFFAOYSA-N
Compound name
N-[[3-(4-acetylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

16
References

14
Patents

276.111 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.11828 162.4
[M+Na]+ 299.10022 168.8
[M-H]- 275.10372 168.6
[M+NH4]+ 294.14482 177.1
[M+K]+ 315.07416 167.7
[M+H-H2O]+ 259.10826 154.9
[M+HCOO]- 321.10920 182.9
[M+CH3COO]- 335.12485 200.8
[M+Na-2H]- 297.08567 162.9
[M]+ 276.11045 163.3
[M]- 276.11155 163.3
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