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]+ 194.061186 136.1
[M+Na]+ 216.043128 146.8
[M-H]- 192.046634 136.2
[M+NH4]+ 211.087733 154.5
[M+K]+ 232.017068 141.9
[M+H-H2O]+ 176.051170 129.3
[M+HCOO]- 238.052111 155.5
[M+CH3COO]- 252.067761 178.7
[M+Na-2H]- 214.028576 143.4
[M]+ 193.05336142 134.3
[M]- 193.05445858 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.