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(1R,5R)-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,5R)-2-Acetyl-5-(4-bromo-phenyl)-1-methyl-4,5-dihydro-1H-1lambda*4*-thiophen-3-ol anion
SpectraBase Compound ID IWTMp67pO1f
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-/m1/s1
InChIKey MSGJZTJFESTPLW-GFCCVEGCSA-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 KVnCau6gFoW
Name (1R,5R)-2-Acetyl-5-(4-bromo-phenyl)-1-methyl-4,5-dihydro-1H-1lambda*4*-thiophen-3-ol anion
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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-/m1/s1
InChIKey MSGJZTJFESTPLW-GFCCVEGCSA-M
Molecular Weight 314.217 g/mol
SMILES S1([C@](CC(=C1C(=O)C)[O-])(c1ccc(cc1)Br)[H])C
SPLASH splash10-01px-9303000000-9f6056482d4fc17cccbd
Source of Spectrum E1-38-333-6
Synonyms (1R,5R)-2-acetyl-5-(4-bromophenyl)-1-methyl-4,5-dihydro-1H-1lambda(4)-thiophen-3-olate trans-2-Acetyl-3-oxo-5-(4-bromophenyl)-1-methylthiolane-2-ylide
Wiley ID 1518152