CID 2814138

N-(1h-indol-5-yl)benzamide

Structural Information

Molecular Formula

C₁₅H₁₂N₂O

SMILES

C1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)NC=C3

InChI

InChI=1S/C15H12N2O/c18-15(11-4-2-1-3-5-11)17-13-6-7-14-12(10-13)8-9-16-14/h1-10,16H,(H,17,18)

InChIKey

JCAFGYWSIWYMOX-UHFFFAOYSA-N

Compound name

N-(1H-indol-5-yl)benzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 7
References: 56
Patents: 236.09496 Da
Monoisotopic Mass: 2.7
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]+	237.10224	152.4
[M+Na]+	259.08418	166.6
[M+NH4]+	254.12878	161.3
[M+K]+	275.05812	160.6
[M-H]-	235.08768	157.0
[M+Na-2H]-	257.06963	161.8
[M]+	236.09441	155.7
[M]-	236.09551	155.7

Literature stripe

literature stripe

Patent stripe

patents stripe