CID 10546267

210179-44-5

Structural Information

Molecular Formula

C₂₄H₂₃NO₂

SMILES

CCCCN1C=C(C2=CC=CC=C21)C(=O)C3=CC=C(C4=CC=CC=C43)OC

InChI

InChI=1S/C24H23NO2/c1-3-4-15-25-16-21(18-10-7-8-12-22(18)25)24(26)20-13-14-23(27-2)19-11-6-5-9-17(19)20/h5-14,16H,3-4,15H2,1-2H3

InChIKey

PGOAKRPGOLHODL-UHFFFAOYSA-N

Compound name

(1-butylindol-3-yl)-(4-methoxynaphthalen-1-yl)methanone

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 357.17288 Da
Monoisotopic Mass: 5.7
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]+	358.180156	189.0
[M+Na]+	380.162098	198.0
[M-H]-	356.165604	196.5
[M+NH4]+	375.206703	204.3
[M+K]+	396.136038	191.4
[M+H-H2O]+	340.170140	179.6
[M+HCOO]-	402.171081	209.6
[M+CH3COO]-	416.186731	199.9
[M+Na-2H]-	378.147546	191.4
[M]+	357.17233142	194.4
[M]-	357.17342858	194.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe