CID 24276386

7-fluoro-3-(hydroxymethyl)-1,2-dihydroquinolin-2-one

Structural Information

Molecular Formula
C10H8FNO2
SMILES
C1=CC2=C(C=C1F)NC(=O)C(=C2)CO
InChI
InChI=1S/C10H8FNO2/c11-8-2-1-6-3-7(5-13)10(14)12-9(6)4-8/h1-4,13H,5H2,(H,12,14)
InChIKey
QPEUMKYVFQOKDD-UHFFFAOYSA-N
Compound name
7-fluoro-3-(hydroxymethyl)-1H-quinolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

193.05391 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.06119 136.1
[M+Na]+ 216.04313 146.8
[M-H]- 192.04663 136.2
[M+NH4]+ 211.08773 154.5
[M+K]+ 232.01707 141.9
[M+H-H2O]+ 176.05117 129.3
[M+HCOO]- 238.05211 155.5
[M+CH3COO]- 252.06776 178.7
[M+Na-2H]- 214.02858 143.4
[M]+ 193.05336 134.3
[M]- 193.05446 134.3
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.