CID 43286787

4-(2-fluorophenyl)-2,3-dihydro-1,3-thiazol-2-one

Structural Information

Molecular Formula
C9H6FNOS
SMILES
C1=CC=C(C(=C1)C2=CSC(=O)N2)F
InChI
InChI=1S/C9H6FNOS/c10-7-4-2-1-3-6(7)8-5-13-9(12)11-8/h1-5H,(H,11,12)
InChIKey
WPBUAOKGWQBCMU-UHFFFAOYSA-N
Compound name
4-(2-fluorophenyl)-3H-1,3-thiazol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

195.01541 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.02269 135.2
[M+Na]+ 218.00463 146.4
[M-H]- 194.00813 139.3
[M+NH4]+ 213.04923 155.4
[M+K]+ 233.97857 141.5
[M+H-H2O]+ 178.01267 128.5
[M+HCOO]- 240.01361 153.7
[M+CH3COO]- 254.02926 149.2
[M+Na-2H]- 215.99008 137.7
[M]+ 195.01486 135.0
[M]- 195.01596 135.0
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.