CID 83396983

7-fluoro-2h-chromene-3-carboxylic acid

Structural Information

Molecular Formula
C10H7FO3
SMILES
C1C(=CC2=C(O1)C=C(C=C2)F)C(=O)O
InChI
InChI=1S/C10H7FO3/c11-8-2-1-6-3-7(10(12)13)5-14-9(6)4-8/h1-4H,5H2,(H,12,13)
InChIKey
MFOXKLIIWABFMG-UHFFFAOYSA-N
Compound name
7-fluoro-2H-chromene-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.03792 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.04520 135.2
[M+Na]+ 217.02714 144.2
[M-H]- 193.03064 138.3
[M+NH4]+ 212.07174 153.9
[M+K]+ 233.00108 142.6
[M+H-H2O]+ 177.03518 128.9
[M+HCOO]- 239.03612 154.4
[M+CH3COO]- 253.05177 180.7
[M+Na-2H]- 215.01259 142.5
[M]+ 194.03737 134.4
[M]- 194.03847 134.4
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.