Dataset

fast-atom bombardment mass spectrometry (FABMS)

Chemical Info

InChI	InChI=1S/2C10H8N2.2ClH.2H2O.Ru/c2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;;;;;/h2*1-8H;2*1H;2*1H2;/q;;;;;;+2/p-2
SMILES	c1ccc(nc1)c1ccccn1.c1ccc(nc1)c1ccccn1.Cl[Ru]Cl.O.O
InChI Key	NHKTUSUPCAKVHT-UHFFFAOYSA-L
Molecular Formula	C20H20Cl2N4O2Ru
Exact Mass	520.374 g/mol

Data and Resources

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Metadata Information

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• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/NHKTUSUPCAKVHT-UHFFFAOYSA-L/CHMO0000563
License URL
Source	https://www.chemotion-repository.net/inchikey/NHKTUSUPCAKVHT-UHFFFAOYSA-L/CHMO0000563
Version
Author	Christoph Zippel
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T08:10:39.946223
MetadataModified	2024-09-08T00:06:20.975451
MetadataPublished	2023-01-04

Field	Value
Measurement Technique	fast-atom bombardment mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
2734543	PubChem
71463877	PubChem
32176769	eMolecules
SCHEMBL2152904	SureChEMBL
163198950	PubChem
CB8501462	ChemicalBook
The data in this table is sourced from UniChem at EBI.