CID 6481040

5-fluoro-2-hydroxy-n-(5-methylisoxazol-3-yl)benzamide

Structural Information

Molecular Formula
C11H9FN2O3
SMILES
CC1=CC(=NO1)NC(=O)C2=C(C=CC(=C2)F)O
InChI
InChI=1S/C11H9FN2O3/c1-6-4-10(14-17-6)13-11(16)8-5-7(12)2-3-9(8)15/h2-5,15H,1H3,(H,13,14,16)
InChIKey
VMWPLDMAOYXQGM-UHFFFAOYSA-N
Compound name
5-fluoro-2-hydroxy-N-(5-methyl-1,2-oxazol-3-yl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

236.05972 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.06700 148.1
[M+Na]+ 259.04894 157.4
[M-H]- 235.05244 152.7
[M+NH4]+ 254.09354 164.3
[M+K]+ 275.02288 155.4
[M+H-H2O]+ 219.05698 140.2
[M+HCOO]- 281.05792 170.4
[M+CH3COO]- 295.07357 189.7
[M+Na-2H]- 257.03439 152.2
[M]+ 236.05917 148.5
[M]- 236.06027 148.5
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

No patent data available for this compound.