CID 14470891

Indeno[1,2-b]fluorene-6,12-dione

Structural Information

Molecular Formula

C₂₀H₁₀O₂

SMILES

C1=CC=C2C(=C1)C3=CC4=C(C=C3C2=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C20H10O2/c21-19-13-7-3-1-5-11(13)15-9-18-16(10-17(15)19)12-6-2-4-8-14(12)20(18)22/h1-10H

InChIKey

AAUHGKXJBZEARK-UHFFFAOYSA-N

Compound name

indeno[1,2-b]fluorene-6,12-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 66
Patents: 282.06808 Da
Monoisotopic Mass: 4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	283.07536	162.3
[M+Na]+	305.05730	177.9
[M-H]-	281.06080	172.5
[M+NH4]+	300.10190	186.6
[M+K]+	321.03124	170.5
[M+H-H2O]+	265.06534	156.7
[M+HCOO]-	327.06628	188.5
[M+CH3COO]-	341.08193	177.7
[M+Na-2H]-	303.04275	169.5
[M]+	282.06753	170.2
[M]-	282.06863	170.2

Literature stripe

literature stripe

Patent stripe

patents stripe