CID 58190604

7-fluoro-6-methoxyquinoline

Structural Information

Molecular Formula
C10H8FNO
SMILES
COC1=C(C=C2C(=C1)C=CC=N2)F
InChI
InChI=1S/C10H8FNO/c1-13-10-5-7-3-2-4-12-9(7)6-8(10)11/h2-6H,1H3
InChIKey
SNKVCSRTSDJDKK-UHFFFAOYSA-N
Compound name
7-fluoro-6-methoxyquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

177.05899 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.066266 132.7
[M+Na]+ 200.048208 143.1
[M-H]- 176.051714 135.2
[M+NH4]+ 195.092813 153.0
[M+K]+ 216.022148 140.1
[M+H-H2O]+ 160.056250 125.2
[M+HCOO]- 222.057191 154.7
[M+CH3COO]- 236.072841 181.4
[M+Na-2H]- 198.033656 141.7
[M]+ 177.05844142 133.4
[M]- 177.05953858 133.4
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