CID 60862416

1-(5,6,7,8-tetrahydro-1,6-naphthyridin-6-yl)prop-2-en-1-one

Structural Information

Molecular Formula
C11H12N2O
SMILES
C=CC(=O)N1CCC2=C(C1)C=CC=N2
InChI
InChI=1S/C11H12N2O/c1-2-11(14)13-7-5-10-9(8-13)4-3-6-12-10/h2-4,6H,1,5,7-8H2
InChIKey
FWINXKMYQHLLBM-UHFFFAOYSA-N
Compound name
1-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)prop-2-en-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

188.09496 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.10224 141.6
[M+Na]+ 211.08418 154.6
[M+NH4]+ 206.12878 149.8
[M+K]+ 227.05812 147.6
[M-H]- 187.08768 142.9
[M+Na-2H]- 209.06963 147.4
[M]+ 188.09441 143.6
[M]- 188.09551 143.6
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.