Dataset

elemental analysis (EA)

Chemical Info

InChI	InChI=1S/C19H22N2O2S/c24-19-21(9-3-8-20-10-12-22-13-11-20)14-17-16-5-2-1-4-15(16)6-7-18(17)23-19/h1-2,4-7H,3,8-14H2
SMILES	S=C1Oc2ccc3c(c2CN1CCCN1CCOCC1)cccc3
InChI Key	UMKRDQFXYJCILQ-UHFFFAOYSA-N
Molecular Formula	C19H22N2O2S
Exact Mass	342.455 g/mol

Data and Resources

• elemental analysis (EA)HTML
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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/UMKRDQFXYJCILQ-UHFFFAOYSA-N/CHMO0001075
License URL
Source	https://www.chemotion-repository.net/inchikey/UMKRDQFXYJCILQ-UHFFFAOYSA-N/CHMO0001075
Version
Author	Andreas Link
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T00:58:35.712093
MetadataModified	2024-09-08T00:58:35.712098
MetadataPublished	2023-05-18

Field	Value
Measurement Technique	elemental analysis
Measurement Variables

Data-Source Molecule ID	Data-Source
168059109	PubChem
The data in this table is sourced from UniChem at EBI.