CID 627535

4-hydroxy-2-phenyl-6-quinolinesulfonyl fluoride

Structural Information

Molecular Formula
C15H10FNO3S
SMILES
C1=CC=C(C=C1)C2=CC(=O)C3=C(N2)C=CC(=C3)S(=O)(=O)F
InChI
InChI=1S/C15H10FNO3S/c16-21(19,20)11-6-7-13-12(8-11)15(18)9-14(17-13)10-4-2-1-3-5-10/h1-9H,(H,17,18)
InChIKey
PLKAKDFVEVGIBV-UHFFFAOYSA-N
Compound name
4-oxo-2-phenyl-1H-quinoline-6-sulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

303.03653 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.04381 163.9
[M+Na]+ 326.02575 174.9
[M-H]- 302.02925 168.4
[M+NH4]+ 321.07035 178.5
[M+K]+ 341.99969 168.2
[M+H-H2O]+ 286.03379 155.7
[M+HCOO]- 348.03473 178.4
[M+CH3COO]- 362.05038 197.2
[M+Na-2H]- 324.01120 169.7
[M]+ 303.03598 164.9
[M]- 303.03708 164.9
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

patents stripe