Vitas-M small molecule compound

1-(3,3-dimethyl-2-oxobutyl)tetrahydrothiophenium

Catalog ID
STL058924
SMILES O=C(C(C)(C)C)C[S+]1CCCC1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C10H19OS MW 187.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H19OS/c1-10(2,3)9(11)8-12-6-4-5-7-12/h4-8H2,1-3H3/q+1
InChIKey
SEPPOLVJLKCJDB-UHFFFAOYSA-N
Synonyms

1(33dimethyl2oxobutyl)tetrahydro1Hthiophen1iumbromide
1(33dimethyl2oxobutyl)tetrahydrothiophenium
33DIMETHYL1(THIOLAN1IUM1YL)BUTAN2ONE
33DIMETHYL1THIOLANYLBUTAN2ONE
CC(C)(C)C(=O)C(S+)1CCCC1
InChI=1SC10H19OSc110(23)9(11)812645712h48H213H3q+1
O=C(C(C)(C)C)C(S+)1CCCC1
O=C(C(C)(C)C)C(S+)1CCCC1(Br)
ZINC000004371209
ZINC04371209
ZINC4371209

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.