CID 54752945

1338925-11-3

Structural Information

Molecular Formula

C₂₄H₂₄N₂O

SMILES

CCCCCN1C=C(C2=CC=CC=C21)C(=O)NC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C24H24N2O/c1-2-3-8-16-26-17-21(20-13-6-7-15-23(20)26)24(27)25-22-14-9-11-18-10-4-5-12-19(18)22/h4-7,9-15,17H,2-3,8,16H2,1H3,(H,25,27)

InChIKey

GWCQNKRMTGVYIZ-UHFFFAOYSA-N

Compound name

N-naphthalen-1-yl-1-pentylindole-3-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 9
References: 45
Patents: 356.18887 Da
Monoisotopic Mass: 5.8
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]+	357.19615	188.1
[M+Na]+	379.17809	195.6
[M-H]-	355.18159	195.2
[M+NH4]+	374.22269	203.0
[M+K]+	395.15203	188.3
[M+H-H2O]+	339.18613	178.5
[M+HCOO]-	401.18707	209.7
[M+CH3COO]-	415.20272	198.3
[M+Na-2H]-	377.16354	192.0
[M]+	356.18832	191.1
[M]-	356.18942	191.1

Literature stripe

literature stripe

Patent stripe

patents stripe