Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C26H24N2.2ClH/c1-27-17-13-21(14-18-27)9-11-24-7-3-5-23-6-4-8-25(26(23)24)12-10-22-15-19-28(2)20-16-22;;/h3-20H,1-2H3;2*1H/q+2;;/p-2/b11-9+,12-10+;;
SMILES	C[n+]1ccc(cc1)/C=C/c1cccc2c1c(ccc2)/C=C/c1cc[n+](cc1)C.[Cl-].[Cl-]
InChI Key	VIRCVYOPUFMLML-JDDKLYJPSA-L
Molecular Formula	C26H24Cl2N2
Exact Mass	435.388 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/VIRCVYOPUFMLML-JDDKLYJPSA-L/CHMO0000470
License URL
Source	https://www.chemotion-repository.net/inchikey/VIRCVYOPUFMLML-JDDKLYJPSA-L/CHMO0000470
Version
Author	Stefan Bräse
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T00:49:04.297227
MetadataModified	2024-09-08T00:49:04.297233
MetadataPublished	2023-03-24

Field	Value
Measurement Technique	mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
168008329	PubChem
The data in this table is sourced from UniChem at EBI.