CID 10176252

1-methyl-1,7-dihydroquinolin-7-one

Structural Information

Molecular Formula
C10H9NO
SMILES
CN1C=CC=C2C1=CC(=O)C=C2
InChI
InChI=1S/C10H9NO/c1-11-6-2-3-8-4-5-9(12)7-10(8)11/h2-7H,1H3
InChIKey
CLWHNSXKDOCYJS-UHFFFAOYSA-N
Compound name
1-methylquinolin-7-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

159.06842 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.07570 129.8
[M+Na]+ 182.05764 145.8
[M+NH4]+ 177.10224 139.7
[M+K]+ 198.03158 137.9
[M-H]- 158.06114 133.0
[M+Na-2H]- 180.04309 138.6
[M]+ 159.06787 133.1
[M]- 159.06897 133.1
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.