Dataset

EUGENOL.c13

Chemical Info

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

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• Measurement

Field	Value
DOI	10.57992/nmrxiv.p42.s238.d1371
License URL	https://creativecommons.org/licenses/by/4.0/legalcode
Source	https://nmrxiv.org/D1371
Version
Author	Peter Spiteller
Maintainer
Language	english
MetadataCreated	2024-04-22T15:48:41.591161
MetadataModified	2024-09-23T09:29:34.049565
MetadataPublished	2023-12-24 21:57:47

Field	Value
Measurement Technique	13C nuclear magnetic resonance spectroscopy
Measurement Variables	NMR solvent : CDCl3 acquisition nucleus : ['13C'] NMR spectrum by dimensionality : 1 NMR probe : 5 mm BBO BB-1H-D Z-GRD Z8248/080 Temperature : 292.9 K magnetic field strength : 9.391505939358051 Tesla number of scans : 1024 scans nuclear magnetic resonance pulse sequence : zgdc Spectral Width : 199.650185201374 number of data points : 10 points relaxation time measurement : 1 seconds