CID 24265157

1185431-26-8

Structural Information

Molecular Formula
C10H9FN2O
SMILES
C1=CC2=C(C=C1F)NC(=O)C(=C2)CN
InChI
InChI=1S/C10H9FN2O/c11-8-2-1-6-3-7(5-12)10(14)13-9(6)4-8/h1-4H,5,12H2,(H,13,14)
InChIKey
LBGNVBHSPVERES-UHFFFAOYSA-N
Compound name
3-(aminomethyl)-7-fluoro-1H-quinolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

192.06989 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.07717 137.1
[M+Na]+ 215.05911 147.5
[M-H]- 191.06261 138.0
[M+NH4]+ 210.10371 155.7
[M+K]+ 231.03305 142.4
[M+H-H2O]+ 175.06715 129.9
[M+HCOO]- 237.06809 158.2
[M+CH3COO]- 251.08374 183.5
[M+Na-2H]- 213.04456 144.2
[M]+ 192.06934 133.9
[M]- 192.07044 133.9
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.