CID 6477183

Benz[b]acridine-6,11-dione, 12-methyl-

Structural Information

Molecular Formula
C18H11NO2
SMILES
CC1=C2C(=NC3=CC=CC=C13)C(=O)C4=CC=CC=C4C2=O
InChI
InChI=1S/C18H11NO2/c1-10-11-6-4-5-9-14(11)19-16-15(10)17(20)12-7-2-3-8-13(12)18(16)21/h2-9H,1H3
InChIKey
PZGXVTAEJLFKLP-UHFFFAOYSA-N
Compound name
12-methylbenzo[b]acridine-6,11-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

2
Patents

273.07898 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.08626 160.0
[M+Na]+ 296.06820 171.4
[M-H]- 272.07170 165.6
[M+NH4]+ 291.11280 178.2
[M+K]+ 312.04214 165.2
[M+H-H2O]+ 256.07624 151.4
[M+HCOO]- 318.07718 178.6
[M+CH3COO]- 332.09283 172.5
[M+Na-2H]- 294.05365 168.0
[M]+ 273.07843 161.4
[M]- 273.07953 161.4
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

patents stripe