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(3.beta.,4.alpha.,5.alpha.)-(+-)-3-Benzenesulfonylmethyl-4-bromomethyl-5-tert-butyldihydro-2(3H)-furanone
SpectraBase Compound ID 9hI13wWUNIJ
InChI InChI=1S/C16H21BrO4S/c1-16(2,3)14-12(9-17)13(15(18)21-14)10-22(19,20)11-7-5-4-6-8-11/h4-8,12-14H,9-10H2,1-3H3/t12-,13-,14+/m0/s1
InChIKey BGJUJZZMJPMNRU-MELADBBJSA-N
Mol Weight 389.3 g/mol
Molecular Formula C16H21BrO4S
Exact Mass 388.034393 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8HnU2cZhtUB
Name (3.beta.,4.alpha.,5.alpha.)-(+-)-3-Benzenesulfonylmethyl-4-bromomethyl-5-tert-butyldihydro-2(3H)-furanone
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Formula C16H21BrO4S
InChI InChI=1S/C16H21BrO4S/c1-16(2,3)14-12(9-17)13(15(18)21-14)10-22(19,20)11-7-5-4-6-8-11/h4-8,12-14H,9-10H2,1-3H3/t12-,13-,14+/m0/s1
InChIKey BGJUJZZMJPMNRU-MELADBBJSA-N
Molecular Weight 389.304 g/mol
SMILES [C@@]1(C(O[C@]([C@]1(CBr)[H])(C(C)(C)C)[H])=O)(CS(=O)(=O)c1ccccc1)[H]
SPLASH splash10-0a6u-5902000000-6c3f93718d1c69b0d7a5
Source of Spectrum J-64-2069-3
Synonyms (3.alpha.,4.beta.,5.alpha.)-(+-)-3-Benzenesulfonylmethyl-4-bromomethyl-5-tert-butyldihydro-2(3H)-furanone (3S,4S,5R)-4-(bromomethyl)-5-tert-butyl-3-[(phenylsulfonyl)methyl]dihydro-2(3H)-furanone
Wiley ID 1529669