Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Info

InChI	InChI=1S/C21H24N2O3S/c1-2-25-20(24)13-8-14-23-19-12-7-6-11-18(19)22-21(23)27-16-15-26-17-9-4-3-5-10-17/h3-7,9-12H,2,8,13-16H2,1H3
SMILES	CCOC(=O)CCCn1c(SCCOc2ccccc2)nc2c1cccc2
InChI Key	XSPLZMULOSAGDE-UHFFFAOYSA-N
Molecular Formula	C21H24N2O3S
Exact Mass	384.492 g/mol

Data and Resources

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Metadata Information

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Field	Value
DOI	10.14272/XSPLZMULOSAGDE-UHFFFAOYSA-N/NMR/13C/CDCl3/62.5.1
License URL
Source	https://www.chemotion-repository.net/inchikey/XSPLZMULOSAGDE-UHFFFAOYSA-N/NMR/13C/CDCl3/62.5.1
Version
Author	Steven Susanto
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-06T22:19:12.195942
MetadataModified	2024-09-07T14:12:59.958386
MetadataPublished	2016-02-15

Field	Value
Measurement Technique	13C nuclear magnetic resonance spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
118701004	PubChem
The data in this table is sourced from UniChem at EBI.