CID 3010847

4-methyl-4a,10a-dihydrobenzo[g]quinoline-5,10-dione

Structural Information

Molecular Formula
C14H11NO2
SMILES
CC1=CC=NC2C1C(=O)C3=CC=CC=C3C2=O
InChI
InChI=1S/C14H11NO2/c1-8-6-7-15-12-11(8)13(16)9-4-2-3-5-10(9)14(12)17/h2-7,11-12H,1H3
InChIKey
ABAQJBITDDBBBW-UHFFFAOYSA-N
Compound name
4-methyl-4a,10a-dihydrobenzo[g]quinoline-5,10-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

225.07898 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.08626 146.7
[M+Na]+ 248.06820 156.8
[M-H]- 224.07170 151.1
[M+NH4]+ 243.11280 166.0
[M+K]+ 264.04214 152.4
[M+H-H2O]+ 208.07624 139.4
[M+HCOO]- 270.07718 165.8
[M+CH3COO]- 284.09283 159.7
[M+Na-2H]- 246.05365 153.8
[M]+ 225.07843 146.4
[M]- 225.07953 146.4
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.