CID 129962145

7-(difluoromethoxy)quinolin-2-ol

Structural Information

Molecular Formula
C10H7F2NO2
SMILES
C1=CC(=CC2=C1C=CC(=O)N2)OC(F)F
InChI
InChI=1S/C10H7F2NO2/c11-10(12)15-7-3-1-6-2-4-9(14)13-8(6)5-7/h1-5,10H,(H,13,14)
InChIKey
CVDATMHMWLFZLW-UHFFFAOYSA-N
Compound name
7-(difluoromethoxy)-1H-quinolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

211.04448 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.051756 138.6
[M+Na]+ 234.033698 148.5
[M-H]- 210.037204 138.3
[M+NH4]+ 229.078303 156.5
[M+K]+ 250.007638 144.4
[M+H-H2O]+ 194.041740 130.3
[M+HCOO]- 256.042681 157.4
[M+CH3COO]- 270.058331 183.7
[M+Na-2H]- 232.019146 145.3
[M]+ 211.04393142 136.4
[M]- 211.04502858 136.4
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

No patent data available for this compound.