Dataset

EUGENOL.jres

Chemical Info

molecular Image

InChI	InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3
SMILES	C=CCC1=CC(OC)=C(O)C=C1
InChI Key	RRAFCDWBNXTKKO-UHFFFAOYSA-N
Molecular Formula	C10H12O2
Exact Mass	164.200 g/mol

Data and Resources

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Metadata Information

Field	Value
DOI	10.57992/nmrxiv.p42.s238.d1370
License URL	https://creativecommons.org/licenses/by/4.0/legalcode
Source	https://nmrxiv.org/D1370
Version
Author	Peter Spiteller
Maintainer
Language	english
MetadataCreated	2024-04-22T15:48:38.981825
MetadataModified	2024-09-23T09:29:33.758283
MetadataPublished	2023-12-24 21:57:47

Field	Value
Measurement Technique	j
Measurement Variables	NMR solvent : CDCl3 acquisition nucleus : ['1H', 'Hz'] NMR spectrum by dimensionality : 2 NMR probe : 5 mm BBO BB-1H-D Z-GRD Z8248/080 Temperature : 293.7 K magnetic field strength : 9.3935106991479 Tesla number of scans : 4 scans nuclear magnetic resonance pulse sequence : jresqf Spectral Width : [5.00858630695064, 0.125014314221488] number of data points : 5 points relaxation time measurement : 2 seconds