Dataset

19F nuclear magnetic resonance spectroscopy (19F NMR)

Chemical Info

InChI	InChI=1S/C21H14FNO/c22-19-14-12-18(13-15-19)21(24)23-20-9-5-4-8-17(20)11-10-16-6-2-1-3-7-16/h1-9,12-15H,(H,23,24)
SMILES	Fc1ccc(cc1)C(=O)Nc1ccccc1C#Cc1ccccc1
InChI Key	LKLDIHYBMWLVIA-UHFFFAOYSA-N
Molecular Formula	C21H14FNO
Exact Mass	315.340 g/mol

Data and Resources

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Metadata Information

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• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/LKLDIHYBMWLVIA-UHFFFAOYSA-N/CHMO0000597
License URL
Source	https://www.chemotion-repository.net/inchikey/LKLDIHYBMWLVIA-UHFFFAOYSA-N/CHMO0000597
Version
Author	Helena Šimek
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T08:07:51.662629
MetadataModified	2024-09-08T00:02:34.032276
MetadataPublished	2022-12-19

Field	Value
Measurement Technique	19F nuclear magnetic resonance spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
102598340	PubChem
J3.113.093J	Nikkaji
The data in this table is sourced from UniChem at EBI.