CID 14581385

6-fluoronaphthalene-1-carboxylic acid

Structural Information

Molecular Formula
C11H7FO2
SMILES
C1=CC2=C(C=CC(=C2)F)C(=C1)C(=O)O
InChI
InChI=1S/C11H7FO2/c12-8-4-5-9-7(6-8)2-1-3-10(9)11(13)14/h1-6H,(H,13,14)
InChIKey
PRGBEFGWVMWEGQ-UHFFFAOYSA-N
Compound name
6-fluoronaphthalene-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

148
Patents

190.04301 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.05029 137.3
[M+Na]+ 213.03223 150.8
[M+NH4]+ 208.07683 145.8
[M+K]+ 229.00617 144.2
[M-H]- 189.03573 138.4
[M+Na-2H]- 211.01768 143.9
[M]+ 190.04246 139.5
[M]- 190.04356 139.5
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