Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C24H26S2/c1-17-3-7-19(8-4-17)25-23-11-21(12-23,13-23)22-14-24(15-22,16-22)26-20-9-5-18(2)6-10-20/h3-10H,11-16H2,1-2H3
SMILES	Cc1ccc(cc1)SC12CC(C1)(C2)C12CC(C1)(C2)Sc1ccc(cc1)C
InChI Key	AUAIDTHVAFAXGQ-UHFFFAOYSA-N
Molecular Formula	C24H26S2
Exact Mass	378.593 g/mol

Data and Resources

• mass spectrometry (MS)HTML
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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/AUAIDTHVAFAXGQ-UHFFFAOYSA-N/Mass.1
License URL
Source	https://www.chemotion-repository.net/inchikey/AUAIDTHVAFAXGQ-UHFFFAOYSA-N/Mass.1
Version
Author	Robin Bär
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T00:51:25.215856
MetadataModified	2024-09-07T14:45:27.304823
MetadataPublished	2019-02-11

Field	Value
Measurement Technique	mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
137331335	PubChem
The data in this table is sourced from UniChem at EBI.