Dataset

4-[1,3-dithiolan-2-ylidene(phenyl)methyl]-5-methylhexan-2-one

This dataset contains experimental data from a sample (4-[1,3-dithiolan-2-ylidene(phenyl)methyl]-5-methylhexan-2-one, InChI=1S/C17H22OS2/c1-12(2)15(11-13(3)18)16(17-19-9-10-20-17)14-7-5-4-6-8-14/h4-8,12,15H,9-11H2,1-3H3).

Chemical Info

molecular Image
InChI InChI=1S/C17H22OS2/c1-12(2)15(11-13(3)18)16(17-19-9-10-20-17)14-7-5-4-6-8-14/h4-8,12,15H,9-11H2,1-3H3
SMILES CC(=O)CC(C(=C1SCCS1)c1ccccc1)C(C)C
InChI Key AJUPULBPXRSZPK-UHFFFAOYSA-N
Molecular Formula C17H22OS2
Exact Mass 306.496 g/mol

Data and Resources

Related Resources

Metadata Information

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DOI
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Author Gräßle, Simone
Maintainer chemotion.net
Language en
MetadataCreated 2022-10-06T14:24:44.574384
MetadataModified 2022-10-06T14:24:44.574389
MetadataPublished
Field Value
Measurement Technique
Measurement Variables