CID 21818204

6-fluoroquinoline-8-carbaldehyde

Structural Information

Molecular Formula
C10H6FNO
SMILES
C1=CC2=CC(=CC(=C2N=C1)C=O)F
InChI
InChI=1S/C10H6FNO/c11-9-4-7-2-1-3-12-10(7)8(5-9)6-13/h1-6H
InChIKey
WDNMGOKPEQFEOB-UHFFFAOYSA-N
Compound name
6-fluoroquinoline-8-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

175.04333 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.05061 131.3
[M+Na]+ 198.03255 142.1
[M-H]- 174.03605 133.9
[M+NH4]+ 193.07715 151.7
[M+K]+ 214.00649 138.4
[M+H-H2O]+ 158.04059 124.0
[M+HCOO]- 220.04153 153.6
[M+CH3COO]- 234.05718 180.5
[M+Na-2H]- 196.01800 140.4
[M]+ 175.04278 131.3
[M]- 175.04388 131.3
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