CID 91743259

1354631-21-2

Structural Information

Molecular Formula

C₂₄H₂₃NO

SMILES

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

InChI

InChI=1S/C24H23NO/c1-3-4-15-25-16-22(20-11-7-8-12-23(20)25)24(26)21-14-13-17(2)18-9-5-6-10-19(18)21/h5-14,16H,3-4,15H2,1-2H3

InChIKey

DOKBVCMQPGKQGV-UHFFFAOYSA-N

Compound name

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

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 341.17798 Da
Monoisotopic Mass: 6.1
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]+	342.185256	185.7
[M+Na]+	364.167198	195.0
[M-H]-	340.170704	193.2
[M+NH4]+	359.211803	201.7
[M+K]+	380.141138	187.6
[M+H-H2O]+	324.175240	176.5
[M+HCOO]-	386.176181	206.1
[M+CH3COO]-	400.191831	196.7
[M+Na-2H]-	362.152646	188.0
[M]+	341.17743142	189.7
[M]-	341.17852858	189.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe