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]+ 172.07570 132.1
[M+Na]+ 194.05764 142.7
[M-H]- 170.06114 135.9
[M+NH4]+ 189.10224 152.7
[M+K]+ 210.03158 138.7
[M+H-H2O]+ 154.06568 125.7
[M+HCOO]- 216.06662 155.3
[M+CH3COO]- 230.08227 180.1
[M+Na-2H]- 192.04309 141.3
[M]+ 171.06787 132.9
[M]- 171.06897 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.