CID 29939761

948553-68-2

Structural Information

Molecular Formula
C8H6FNO2
SMILES
C1C2=C(C=CC(=C2F)O)NC1=O
InChI
InChI=1S/C8H6FNO2/c9-8-4-3-7(12)10-5(4)1-2-6(8)11/h1-2,11H,3H2,(H,10,12)
InChIKey
XVAYHKRLBOJOQF-UHFFFAOYSA-N
Compound name
4-fluoro-5-hydroxy-1,3-dihydroindol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

167.03825 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.045526 129.6
[M+Na]+ 190.027468 140.1
[M-H]- 166.030974 129.7
[M+NH4]+ 185.072073 150.9
[M+K]+ 206.001408 136.0
[M+H-H2O]+ 150.035510 123.9
[M+HCOO]- 212.036451 149.0
[M+CH3COO]- 226.052101 172.8
[M+Na-2H]- 188.012916 134.5
[M]+ 167.03770142 126.4
[M]- 167.03879858 126.4
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.