CID 66545136

2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-1,2-oxazolidin-4-ol

Structural Information

Molecular Formula
C9H8ClF3N2O2
SMILES
C1C(CON1C2=C(C=C(C=N2)C(F)(F)F)Cl)O
InChI
InChI=1S/C9H8ClF3N2O2/c10-7-1-5(9(11,12)13)2-14-8(7)15-3-6(16)4-17-15/h1-2,6,16H,3-4H2
InChIKey
ZOUZSXLXKJUWIM-UHFFFAOYSA-N
Compound name
2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2-oxazolidin-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

268.02264 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.029916 151.4
[M+Na]+ 291.011858 161.6
[M-H]- 267.015364 151.2
[M+NH4]+ 286.056463 166.0
[M+K]+ 306.985798 157.7
[M+H-H2O]+ 251.019900 142.3
[M+HCOO]- 313.020841 161.2
[M+CH3COO]- 327.036491 189.6
[M+Na-2H]- 288.997306 154.2
[M]+ 268.02209142 148.4
[M]- 268.02318858 148.4
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.