CID 86664732

6-fluoro-2,3-dihydroxybenzaldehyde

Structural Information

Molecular Formula
C7H5FO3
SMILES
C1=CC(=C(C(=C1O)O)C=O)F
InChI
InChI=1S/C7H5FO3/c8-5-1-2-6(10)7(11)4(5)3-9/h1-3,10-11H
InChIKey
WMIMSXVENWNCNJ-UHFFFAOYSA-N
Compound name
6-fluoro-2,3-dihydroxybenzaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

35
Patents

156.02228 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.02956 128.3
[M+Na]+ 179.01150 140.3
[M+NH4]+ 174.05610 135.3
[M+K]+ 194.98544 135.4
[M-H]- 155.01500 127.6
[M+Na-2H]- 176.99695 133.4
[M]+ 156.02173 129.6
[M]- 156.02283 129.6
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