3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one bromide

Systemtic Name: 3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one bromide Openeye Name: 3,3-dimethyl-1-tetrahydrothiophen-1-ium-1-yl-butan-2-one bromide CAS Name: 3,3-dimethyl-1-(1-thiolan-1-iumyl)-2-butanone bromide IUPAC Name: 3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one bromide Traditional Name: 3,3-dimethyl-1-tetrahydrothiophen-1-ium-1-yl-butan-2-one bromide Formula: C10H19BrOS MolecularWeight: 267.22626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C[S+]1CCCC1.[Br-]

Isomeric SMILES

CC(C)(C)C(=O)C[S+]1CCCC1.[Br-]

InChI

InChI=1S/C10H19OS.BrH/c1-10(2,3)9(11)8-12-6-4-5-7-12;/h4-8H2,1-3H3;1H/q+1;/p-1