Dataset

620-71-3.

Chemical Info

InChI	InChI=1S/C9H11NO/c1-2-9(11)10-8-6-4-3-5-7-8/h3-7H,2H2,1H3,(H,10,11)
SMILES	CCC(=O)NC1=CC=CC=C1
InChI Key	ZTHRQJQJODGZHV-UHFFFAOYSA-N
Molecular Formula	C9H11NO
Exact Mass	149.190 g/mol

Data and Resources

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Metadata Information

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• Measurement

Field	Value
DOI	10.57992/nmrxiv.p10.s62.d295
License URL	https://creativecommons.org/licenses/by/4.0/legalcode
Source	https://nmrxiv.org/D295
Version
Author
Maintainer
Language	english
MetadataCreated	2024-04-22T16:13:50.586460
MetadataModified	2024-05-15T08:30:27.708216
MetadataPublished	2022-10-28 13:30:58

Field	Value
Measurement Technique
Measurement Variables	NMR solvent : CDCl3 acquisition nucleus : 1H NMR spectrum by dimensionality : 1 NMR probe : 5 mm BBI 1H-BB-D Z-GRD LTB Z5542/0003 Temperature : 283 K magnetic field strength : 11.746350827011339 Tesla number of scans : 32 scans nuclear magnetic resonance pulse sequence : selnogp.nes Spectral Width : 9.18874585008181 number of data points : 8192 points relaxation time measurement : 1.2 seconds