CID 14056792

4269-14-1

Structural Information

Molecular Formula

C₁₉H₁₂O

SMILES

C1=CC=C(C=C1)C2=C3C4=CC=CC=C4C(=O)C3=CC=C2

InChI

InChI=1S/C19H12O/c20-19-16-10-5-4-9-15(16)18-14(11-6-12-17(18)19)13-7-2-1-3-8-13/h1-12H

InChIKey

IBMDJUVDKKHHTP-UHFFFAOYSA-N

Compound name

4-phenylfluoren-9-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 12
Patents: 256.0888 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]+	257.09608	157.2
[M+Na]+	279.07802	167.5
[M-H]-	255.08152	166.5
[M+NH4]+	274.12262	178.0
[M+K]+	295.05196	161.0
[M+H-H2O]+	239.08606	150.0
[M+HCOO]-	301.08700	180.7
[M+CH3COO]-	315.10265	170.8
[M+Na-2H]-	277.06347	163.5
[M]+	256.08825	158.1
[M]-	256.08935	158.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe