CID 9547781

7-fluoro-2-methylquinolin-4-ol

Structural Information

Molecular Formula
C10H8FNO
SMILES
CC1=CC(=O)C2=C(N1)C=C(C=C2)F
InChI
InChI=1S/C10H8FNO/c1-6-4-10(13)8-3-2-7(11)5-9(8)12-6/h2-5H,1H3,(H,12,13)
InChIKey
DGZLIRLGDGAYDG-UHFFFAOYSA-N
Compound name
7-fluoro-2-methyl-1H-quinolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

177.05899 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.066266 132.2
[M+Na]+ 200.048208 143.4
[M-H]- 176.051714 133.7
[M+NH4]+ 195.092813 152.1
[M+K]+ 216.022148 138.9
[M+H-H2O]+ 160.056250 125.4
[M+HCOO]- 222.057191 152.9
[M+CH3COO]- 236.072841 179.1
[M+Na-2H]- 198.033656 140.0
[M]+ 177.05844142 130.7
[M]- 177.05953858 130.7
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