Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Info

InChI	InChI=1S/C9H5Cl2F3/c10-7-2-1-3-8(11)6(7)4-5-9(12,13)14/h1-5H/b5-4+
SMILES	FC(/C=C/c1c(Cl)cccc1Cl)(F)F
InChI Key	QLDAKGDKBBUQEF-SNAWJCMRSA-N
Molecular Formula	C9H5Cl2F3
Exact Mass	241.037 g/mol

Data and Resources

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Metadata Information

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• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/QLDAKGDKBBUQEF-SNAWJCMRSA-N/NMR/1H/CDCl3/400
License URL
Source	https://www.chemotion-repository.net/inchikey/QLDAKGDKBBUQEF-SNAWJCMRSA-N/NMR/1H/CDCl3/400
Version
Author	Andreas Hafner
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-06T23:29:24.235441
MetadataModified	2024-09-07T12:40:32.110136
MetadataPublished	2014-05-27
Related Molecule

Field	Value
Measurement Technique	1H nuclear magnetic resonance spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
J3.319.433A	Nikkaji
72793508	PubChem
The data in this table is sourced from UniChem at EBI.