Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Info

InChI	InChI=1S/C9H14N2O/c1-6-9(12)11-8-5-3-2-4-7(8)10-6/h7-8H,2-5H2,1H3,(H,11,12)
SMILES	O=C1NC2CCCCC2N=C1C
InChI Key	JMGVYJTUNKOEAL-UHFFFAOYSA-N
Molecular Formula	C9H14N2O
Exact Mass	166.220 g/mol

Data and Resources

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Metadata Information

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• Molecule Data-Sources

Field	Value
DOI	10.14272/JMGVYJTUNKOEAL-UHFFFAOYSA-N/NMR/13C/CDCl3/75.1
License URL
Source	https://www.chemotion-repository.net/inchikey/JMGVYJTUNKOEAL-UHFFFAOYSA-N/NMR/13C/CDCl3/75.1
Version
Author	Nicole Jung
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-06T21:33:29.684034
MetadataModified	2024-09-07T14:06:46.004638
MetadataPublished	2015-07-30

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

Data-Source Molecule ID	Data-Source
91618481	PubChem
The data in this table is sourced from UniChem at EBI.