Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Info

InChI	InChI=1S/C16H10N2/c1-2-13-16(12-8-4-3-5-9-12)18-15-11-7-6-10-14(15)17-13/h1,3-11H
SMILES	C#Cc1nc2ccccc2nc1c1ccccc1
InChI Key	DSXBCLGEUHXJHK-UHFFFAOYSA-N
Molecular Formula	C16H10N2
Exact Mass	230.264 g/mol

Data and Resources

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Metadata Information

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• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/DSXBCLGEUHXJHK-UHFFFAOYSA-N/CHMO0000593
License URL
Source	https://www.chemotion-repository.net/inchikey/DSXBCLGEUHXJHK-UHFFFAOYSA-N/CHMO0000593
Version
Author	Jérôme Klein
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T05:22:37.766772
MetadataModified	2024-09-07T20:50:38.391384
MetadataPublished	2021-12-26
Related Molecule

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

Data-Source Molecule ID	Data-Source
162369938	PubChem
The data in this table is sourced from UniChem at EBI.