CID 10184

11h-benzo[a]fluoren-11-one

Structural Information

Molecular Formula

C₁₇H₁₀O

SMILES

C1=CC=C2C(=C1)C=CC3=C2C(=O)C4=CC=CC=C34

InChI

InChI=1S/C17H10O/c18-17-15-8-4-3-7-13(15)14-10-9-11-5-1-2-6-12(11)16(14)17/h1-10H

InChIKey

RNICURKFVSAHLQ-UHFFFAOYSA-N

Compound name

benzo[a]fluoren-11-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 4
References: 177
Patents: 230.07317 Da
Monoisotopic Mass: 4.3
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]+	231.08045	149.0
[M+Na]+	253.06239	166.1
[M+NH4]+	248.10699	160.9
[M+K]+	269.03633	157.8
[M-H]-	229.06589	154.4
[M+Na-2H]-	251.04784	157.0
[M]+	230.07262	153.3
[M]-	230.07372	153.3

Literature stripe

literature stripe

Patent stripe

patents stripe