Molecule

(1-butylindol-3-yl)-naphthalen-1-ylmethanone

Chemical Information

Molecular Image

InChI	InChI=1S/C23H21NO/c1-2-3-15-24-16-21(19-12-6-7-14-22(19)24)23(25)20-13-8-10-17-9-4-5-11-18(17)20/h4-14,16H,2-3,15H2,1H3
SMILES	CCCCN1C=C(C2=CC=CC=C21)C(=O)C3=CC=CC4=CC=CC=C43
InChI Key	VCHHHSMPMLNVGS-UHFFFAOYSA-N
Exact Mass	327.162 g/mol

13 Related Dataset(s) ⌄

infrared absorption spectroscopy (IR)

JWH-073; LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+

JWH-073; LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+Na]+

JWH-073; LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+

JWH-073; LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+Na]+

JWH-073; LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+

JWH-073; LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+

JWH-073; LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+H]+

JWH-073; LC-ESI-QTOF; MS2; HILIC; CE: 10 eV; R=35000; [M+H]+

JWH-073; LC-ESI-QTOF; MS2; HILIC; CE: 20 eV; R=35000; [M+H]+

JWH-073; LC-ESI-QTOF; MS2; HILIC; CE: 30 eV; R=35000; [M+H]+

JWH-073; LC-ESI-QTOF; MS2; HILIC; CE: 40 eV; R=35000; [M+H]+

JWH-073; LC-ESI-QTOF; MS2; HILIC; CE: 50 eV; R=35000; [M+H]+

Metadata Information

Field	Value
NFDI4Chem Molecule ID	nfdi4chem-mol88186
Source
Alternate Name

Field	Value
No additional information available for this Dataset.

Data-Source Molecule ID	Data-Source
CHEBI:181123	chebi
CHEMBL2380416	chembl
11983320	surechembl
29375790	surechembl
10471670	pubchem
BBX3BP2772	fdasrs
PD016808	probes_and_drugs
EROCIY	CCDC
HMDB0245597	hmdb
DTXSID20175042	comptox
85804	bindingdb
The data in this table is sourced from UniChem at EBI.