CID 497416

(5r)-3-(3-fluoro-4-imidazol-1-yl-phenyl)-5-(1,2,5-thiadiazol-3-yloxymethyl)oxazolidin-2-one

Structural Information

Molecular Formula
C15H12FN5O3S
SMILES
C1[C@@H](OC(=O)N1C2=CC(=C(C=C2)N3C=CN=C3)F)COC4=NSN=C4
InChI
InChI=1S/C15H12FN5O3S/c16-12-5-10(1-2-13(12)20-4-3-17-9-20)21-7-11(24-15(21)22)8-23-14-6-18-25-19-14/h1-6,9,11H,7-8H2/t11-/m1/s1
InChIKey
PWYDUSIXNJEFOB-LLVKDONJSA-N
Compound name
(5R)-3-(3-fluoro-4-imidazol-1-ylphenyl)-5-(1,2,5-thiadiazol-3-yloxymethyl)-1,3-oxazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

361.06448 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 362.07176 175.4
[M+Na]+ 384.05370 187.7
[M-H]- 360.05720 184.2
[M+NH4]+ 379.09830 186.3
[M+K]+ 400.02764 184.5
[M+H-H2O]+ 344.06174 166.4
[M+HCOO]- 406.06268 191.3
[M+CH3COO]- 420.07833 187.1
[M+Na-2H]- 382.03915 171.3
[M]+ 361.06393 180.9
[M]- 361.06503 180.9
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.