Dataset

Ethylbenzene.1d

Chemical Info

InChI	InChI=1S/C8H10/c1-2-8-6-4-3-5-7-8/h3-7H,2H2,1H3
SMILES	CCC1=CC=CC=C1
InChI Key	YNQLUTRBYVCPMQ-UHFFFAOYSA-N
Molecular Formula	C8H10
Exact Mass	106.160 g/mol

Data and Resources

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Metadata Information

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Field	Value
DOI	10.57992/nmrxiv.p4.s37.d83
License URL	https://creativecommons.org/licenses/by/4.0/legalcode
Source	https://nmrxiv.org/D83
Version
Author	Luc Patiny, Hamed Musallam, Michaël Zasso, Alejandro Bolaños, Daniel Kostro, Michael Wenk, Sébastien Ahkrin, Damien Jeannerat, Eva Ziegler, Johannes Liermann, Nils Schloerer, Julien Wist
Maintainer
Language	english
MetadataCreated	2024-04-22T16:50:26.990596
MetadataModified	2024-05-15T09:30:47.237726
MetadataPublished	2022-10-27 13:27:33

Field	Value
Measurement Technique	1H nuclear magnetic resonance spectroscopy
Measurement Variables	NMR solvent : DMSO acquisition nucleus : 1H NMR spectrum by dimensionality : 1 NMR probe : 5 mm CPPBBO BB-1H/19F/D Z-GRD Z130030/0001 Temperature : 298.0016 K magnetic field strength : 9.396516983325728 Tesla number of scans : 8 scans nuclear magnetic resonance pulse sequence : zg30 Spectral Width : 20.5549725710447 number of data points : 65536 points relaxation time measurement : 1 seconds