CID 154897

32306-29-9

Structural Information

Molecular Formula
C13H16NO5P
SMILES
CCOP(=O)(OCC)OC1=NOC(=C1)C2=CC=CC=C2
InChI
InChI=1S/C13H16NO5P/c1-3-16-20(15,17-4-2)19-13-10-12(18-14-13)11-8-6-5-7-9-11/h5-10H,3-4H2,1-2H3
InChIKey
VLBRWDJSOHOVGF-UHFFFAOYSA-N
Compound name
diethyl (5-phenyl-1,2-oxazol-3-yl) phosphate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

297.0766 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.08388 164.4
[M+Na]+ 320.06582 175.4
[M+NH4]+ 315.11042 170.0
[M+K]+ 336.03976 173.1
[M-H]- 296.06932 166.2
[M+Na-2H]- 318.05127 169.9
[M]+ 297.07605 166.2
[M]- 297.07715 166.2
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.