Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C28H24N2P.BrH/c1-22-28(30-27-20-12-11-19-26(27)29-22)21-31(23-13-5-2-6-14-23,24-15-7-3-8-16-24)25-17-9-4-10-18-25;/h2-20H,21H2,1H3;1H/q+1;/p-1
SMILES	Cc1nc2ccccc2nc1C[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Br-]
InChI Key	PMKPMHYYSUCDJK-UHFFFAOYSA-M
Molecular Formula	C28H24BrN2P
Exact Mass	499.381 g/mol

Data and Resources

• mass spectrometry (MS)HTML
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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/PMKPMHYYSUCDJK-UHFFFAOYSA-M/CHMO0000470
License URL
Source	https://www.chemotion-repository.net/inchikey/PMKPMHYYSUCDJK-UHFFFAOYSA-M/CHMO0000470
Version
Author	Jérôme Klein
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T02:56:12.346996
MetadataModified	2024-09-07T17:39:01.564432
MetadataPublished	2020-04-12

Field	Value
Measurement Technique	mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
146019173	PubChem
The data in this table is sourced from UniChem at EBI.