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(1R,5S)-2-Acetyl-5-(4-bromo-phenyl)-1-methyl-4,5-dihydro-1H-1lambda*4*-thiophen-3-ol anion

View entire compound with spectra: 1 MS (GC)

(1R,5S)-2-Acetyl-5-(4-bromo-phenyl)-1-methyl-4,5-dihydro-1H-1lambda*4*-thiophen-3-ol anion
SpectraBase Compound ID Lhw71OsYVbV
InChI InChI=1S/C13H14BrO2S/c1-8(15)13-11(16)7-12(17(13)2)9-3-5-10(14)6-4-9/h3-6,12,16H,7H2,1-2H3/p-1/t12-/m0/s1
InChIKey MSGJZTJFESTPLW-LBPRGKRZSA-M
Mol Weight 314.22 g/mol
Molecular Formula C13H14BrO2S
Exact Mass 312.989789 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3TBlI2d2BAQ
Name (1R,5S)-2-Acetyl-5-(4-bromo-phenyl)-1-methyl-4,5-dihydro-1H-1lambda*4*-thiophen-3-ol anion
Alternate Name(s) (1R,5S)-2-acetyl-5-(4-bromophenyl)-1-methyl-4,5-dihydro-1H-1lambda(4)-thiophen-3-olate cis-2-Acetyl-3-oxo-5-(4-bromophenyl)-1-methylthiolane-2-ylide
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Formula C13H13BrO2S
InChI InChI=1S/C13H14BrO2S/c1-8(15)13-11(16)7-12(17(13)2)9-3-5-10(14)6-4-9/h3-6,12,16H,7H2,1-2H3/p-1/t12-/m0/s1
InChIKey MSGJZTJFESTPLW-LBPRGKRZSA-M
Molecular Weight 314.217 g/mol
SMILES S1([C@@](CC(=C1C(=O)C)[O-])(c1ccc(cc1)Br)[H])C
SPLASH splash10-01po-9706000000-8100cd5cb21fee62e059
Source of Spectrum E1-38-334-7
Wiley ID 1518144