CID 6482979

2-(2,6-difluorophenyl)-3-(2-furylmethyl)thiazolidin-4-one

Structural Information

Molecular Formula
C14H11F2NO2S
SMILES
C1C(=O)N(C(S1)C2=C(C=CC=C2F)F)CC3=CC=CO3
InChI
InChI=1S/C14H11F2NO2S/c15-10-4-1-5-11(16)13(10)14-17(12(18)8-20-14)7-9-3-2-6-19-9/h1-6,14H,7-8H2
InChIKey
SNCMCYPPAAMOSM-UHFFFAOYSA-N
Compound name
2-(2,6-difluorophenyl)-3-(furan-2-ylmethyl)-1,3-thiazolidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

295.04785 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.05513 161.9
[M+Na]+ 318.03707 172.6
[M-H]- 294.04057 169.8
[M+NH4]+ 313.08167 179.3
[M+K]+ 334.01101 168.9
[M+H-H2O]+ 278.04511 154.2
[M+HCOO]- 340.04605 178.2
[M+CH3COO]- 354.06170 174.6
[M+Na-2H]- 316.02252 158.9
[M]+ 295.04730 162.8
[M]- 295.04840 162.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.