CID 10537943

3-(4'-fluorobenzoyl)indole

Structural Information

Molecular Formula

C₁₅H₁₀FNO

SMILES

C1=CC=C2C(=C1)C(=CN2)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C15H10FNO/c16-11-7-5-10(6-8-11)15(18)13-9-17-14-4-2-1-3-12(13)14/h1-9,17H

InChIKey

VWIPMQNJODLVFA-UHFFFAOYSA-N

Compound name

(4-fluorophenyl)-(1H-indol-3-yl)methanone

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 7
Patents: 239.07465 Da
Monoisotopic Mass: 3.8
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]+	240.08193	150.2
[M+Na]+	262.06387	160.2
[M-H]-	238.06737	154.7
[M+NH4]+	257.10847	168.6
[M+K]+	278.03781	154.2
[M+H-H2O]+	222.07191	142.1
[M+HCOO]-	284.07285	171.8
[M+CH3COO]-	298.08850	163.0
[M+Na-2H]-	260.04932	155.4
[M]+	239.07410	149.2
[M]-	239.07520	149.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe