CID 3054473

4(1h)-quinolone, 1-vinyl-

Structural Information

Molecular Formula
C11H9NO
SMILES
C=CN1C=CC(=O)C2=CC=CC=C21
InChI
InChI=1S/C11H9NO/c1-2-12-8-7-11(13)9-5-3-4-6-10(9)12/h2-8H,1H2
InChIKey
RFQOREXGPLJRCO-UHFFFAOYSA-N
Compound name
1-ethenylquinolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

171.06842 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.075696 132.1
[M+Na]+ 194.057638 142.7
[M-H]- 170.061144 135.9
[M+NH4]+ 189.102243 152.7
[M+K]+ 210.031578 138.7
[M+H-H2O]+ 154.065680 125.7
[M+HCOO]- 216.066621 155.3
[M+CH3COO]- 230.082271 180.1
[M+Na-2H]- 192.043086 141.3
[M]+ 171.06787142 132.9
[M]- 171.06896858 132.9
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.