Dataset

fast-atom bombardment mass spectrometry (FABMS)

Chemical Info

InChI	InChI=1S/C25H21N.ClH/c26-24-18-16-23(17-19-24)25(20-10-4-1-5-11-20,21-12-6-2-7-13-21)22-14-8-3-9-15-22;/h1-19H,26H2;1H
SMILES	[NH3+]c1ccc(cc1)C(c1ccccc1)(c1ccccc1)c1ccccc1.[Cl-]
InChI Key	GGYQDMHUVMIEFM-UHFFFAOYSA-N
Molecular Formula	C25H22ClN
Exact Mass	371.902 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/GGYQDMHUVMIEFM-UHFFFAOYSA-N/CHMO0000563
License URL
Source	https://www.chemotion-repository.net/inchikey/GGYQDMHUVMIEFM-UHFFFAOYSA-N/CHMO0000563
Version
Author	Lisa Schmidt
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T02:00:40.309581
MetadataModified	2024-09-08T02:00:40.309589
MetadataPublished	2023-11-24

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

Data-Source Molecule ID	Data-Source
146019163	PubChem
751021	eMolecules
CHEMBL1992106	ChEMBL
MolPort-044-567-475	MolPort
361283	PubChem
The data in this table is sourced from UniChem at EBI.