CID 124225

Ulifloxacin

Structural Information

Molecular Formula
C16H16FN3O3S
SMILES
CC1N2C3=CC(=C(C=C3C(=O)C(=C2S1)C(=O)O)F)N4CCNCC4
InChI
InChI=1S/C16H16FN3O3S/c1-8-20-11-7-12(19-4-2-18-3-5-19)10(17)6-9(11)14(21)13(16(22)23)15(20)24-8/h6-8,18H,2-5H2,1H3,(H,22,23)
InChIKey
SUXQDLLXIBLQHW-UHFFFAOYSA-N
Compound name
6-fluoro-1-methyl-4-oxo-7-piperazin-1-yl-1H-[1,3]thiazeto[3,2-a]quinoline-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

67
References

251
Patents

349.08963 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 350.09691 177.0
[M+Na]+ 372.07885 184.2
[M+NH4]+ 367.12345 179.0
[M+K]+ 388.05279 179.0
[M-H]- 348.08235 174.2
[M+Na-2H]- 370.06430 176.5
[M]+ 349.08908 176.2
[M]- 349.09018 176.2
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

patents stripe