CID 3046895

62826-04-4

Structural Information

Molecular Formula
C11H10F3NO2
SMILES
C1C(OC(=O)N1)CC2=CC(=CC=C2)C(F)(F)F
InChI
InChI=1S/C11H10F3NO2/c12-11(13,14)8-3-1-2-7(4-8)5-9-6-15-10(16)17-9/h1-4,9H,5-6H2,(H,15,16)
InChIKey
STBVNCXMHVPAKQ-UHFFFAOYSA-N
Compound name
5-[[3-(trifluoromethyl)phenyl]methyl]-1,3-oxazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

245.06636 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 246.07364 158.5
[M+Na]+ 268.05558 166.6
[M+NH4]+ 263.10018 163.2
[M+K]+ 284.02952 163.6
[M-H]- 244.05908 156.5
[M+Na-2H]- 266.04103 161.0
[M]+ 245.06581 158.6
[M]- 245.06691 158.6
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

patents stripe