Dataset

26fi[10]

Chemical Information

InChI	InChI=1S/C9H11NO4S/c1-10(9(11)14-2)15(12,13)8-6-4-3-5-7-8/h3-7H,1-2H3
SMILES	COC(=O)N(C)S(=O)(=O)C1=CC=CC=C1
InChI Key	JTOWDMZIIFWGQN-UHFFFAOYSA-N
Exact Mass	229.260 g/mol

Data and Resources

• 26fi[10]HTML
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• 1h-nuclear-magnetic...

Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.57992/nmrxiv.p105.s972.d4581
License URL	https://creativecommons.org/licenses/by/4.0/legalcode
Source	https://nmrxiv.org/D4581
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Maintainer
Language	english
MetadataPublished
Related Molecule

Field	Value
Measurement Technique	1H nuclear magnetic resonance spectroscopy
Measurement Variables	NMR solvent : CDCl3 acquisition nucleus : ['1H'] NMR spectrum by dimensionality : 1 NMR probe : Z116098_0618 (PA BBO 400S1 BBF-H-D-05 Z SP) Temperature : 298.1589 K magnetic field strength : 9.398161044985478 Tesla number of scans : 128 scans nuclear magnetic resonance pulse sequence : zg30 Spectral Width : 30.0366276301356 number of data points : 9 points relaxation time measurement : 0.1 seconds

Data-Source Molecule ID	Data-Source
154280369	PubChem
The data in this table is sourced from UniChem at EBI.