Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C18H16N2/c19-17-11-15(13-7-3-1-4-8-13)16(12-18(17)20)14-9-5-2-6-10-14/h1-12H,19-20H2
SMILES	Nc1cc(c2ccccc2)c(cc1N)c1ccccc1
InChI Key	BEGUWTIVANWACP-UHFFFAOYSA-N
Molecular Formula	C18H16N2
Exact Mass	260.333 g/mol

Data and Resources

• mass spectrometry (MS)HTML
  Explore

  • More information
  • Go to resource

• mass-spectrometry

Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/BEGUWTIVANWACP-UHFFFAOYSA-N/CHMO0000470.1
License URL
Source	https://www.chemotion-repository.net/inchikey/BEGUWTIVANWACP-UHFFFAOYSA-N/CHMO0000470.1
Version
Author	Victor Larignon
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T01:44:50.111845
MetadataModified	2024-09-08T01:44:50.111851
MetadataPublished	2023-11-02

Field	Value
Measurement Technique	mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
J394.069A	Nikkaji
22459211	PubChem
SCHEMBL7649793	SureChEMBL
ZINC000149220790	ZINC
The data in this table is sourced from UniChem at EBI.