Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C24H17N/c1-3-7-17(8-4-1)19-11-13-23-21(15-19)22-16-20(12-14-24(22)25-23)18-9-5-2-6-10-18/h1-16,25H
SMILES	c1ccc(cc1)c1ccc2c(c1)c1cc(ccc1[nH]2)c1ccccc1
InChI Key	PCMKGEAHIZDRFL-UHFFFAOYSA-N
Molecular Formula	C24H17N
Exact Mass	319.398 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/PCMKGEAHIZDRFL-UHFFFAOYSA-N/CHMO0000470
License URL
Source	https://www.chemotion-repository.net/inchikey/PCMKGEAHIZDRFL-UHFFFAOYSA-N/CHMO0000470
Version
Author	Victor Larignon
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T01:47:56.123687
MetadataModified	2024-09-08T01:47:56.123692
MetadataPublished	2023-11-02

Field	Value
Measurement Technique	mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
CB11119047	ChemicalBook
6654-68-8	ACToR
6455681	eMolecules
J3.354.639D	Nikkaji
ABEDOE	CCDC
ZINC000003129953	ZINC
SCHEMBL149685	SureChEMBL
3123295	PubChem
MCULE-8578475353	Mcule
The data in this table is sourced from UniChem at EBI.