CID 3049206

Brn 1162598

Structural Information

Molecular Formula
C17H16FNO4
SMILES
C1C(OC(=O)N1C2=CC=C(C=C2)OCC3=CC(=CC=C3)F)CO
InChI
InChI=1S/C17H16FNO4/c18-13-3-1-2-12(8-13)11-22-15-6-4-14(5-7-15)19-9-16(10-20)23-17(19)21/h1-8,16,20H,9-11H2
InChIKey
ABZDCVKPLOFEIL-UHFFFAOYSA-N
Compound name
3-[4-[(3-fluorophenyl)methoxy]phenyl]-5-(hydroxymethyl)-1,3-oxazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

317.10632 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 318.11360 170.6
[M+Na]+ 340.09554 178.4
[M-H]- 316.09904 177.4
[M+NH4]+ 335.14014 183.2
[M+K]+ 356.06948 175.0
[M+H-H2O]+ 300.10358 161.2
[M+HCOO]- 362.10452 189.4
[M+CH3COO]- 376.12017 202.5
[M+Na-2H]- 338.08099 171.7
[M]+ 317.10577 170.9
[M]- 317.10687 170.9
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.