Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Info

InChI	InChI=1S/C10H8FN/c1-2-7-6-12-10-5-8(11)3-4-9(7)10/h2-6,12H,1H2
SMILES	C=Cc1c[nH]c2c1ccc(c2)F
InChI Key	JZGAWTUCCKMBAR-UHFFFAOYSA-N
Molecular Formula	C10H8FN
Exact Mass	161.176 g/mol

Data and Resources

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Metadata Information

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• Molecule Data-Sources

Field	Value
DOI	10.14272/JZGAWTUCCKMBAR-UHFFFAOYSA-N/NMR/13C/acetone/75
License URL
Source	https://www.chemotion-repository.net/inchikey/JZGAWTUCCKMBAR-UHFFFAOYSA-N/NMR/13C/acetone/75
Version
Author	Sabilla Zhong
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-06T23:30:03.965346
MetadataModified	2024-09-07T12:41:30.198027
MetadataPublished	2014-05-27

Field	Value
Measurement Technique	13C nuclear magnetic resonance spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
73427427	PubChem
ZINC000210532201	ZINC
The data in this table is sourced from UniChem at EBI.