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

View entire compound with spectra: 2 MS (GC)

(1R,5R)-2-Acetyl-5-(4-bromo-phenyl)-1-phenyl-4,5-dihydro-1H-1lambda*4*-thiophen-3-ol anion
SpectraBase Compound ID L9Zr8dgGPjM
InChI InChI=1S/C18H16BrO2S/c1-12(20)18-16(21)11-17(13-7-9-14(19)10-8-13)22(18)15-5-3-2-4-6-15/h2-10,17,21H,11H2,1H3/p-1/t17-/m1/s1
InChIKey VSDLCXBMXGZQBN-QGZVFWFLSA-M
Mol Weight 376.29 g/mol
Molecular Formula C18H16BrO2S
Exact Mass 375.005439 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ExGVuEJT5Vm
Name (1R,5R)-2-Acetyl-5-(4-bromo-phenyl)-1-phenyl-4,5-dihydro-1H-1lambda*4*-thiophen-3-ol anion
Comments Less than 3 mono-isotopic peaks
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Formula C18H15BrO2S
InChI InChI=1S/C18H16BrO2S/c1-12(20)18-16(21)11-17(13-7-9-14(19)10-8-13)22(18)15-5-3-2-4-6-15/h2-10,17,21H,11H2,1H3/p-1/t17-/m1/s1
InChIKey VSDLCXBMXGZQBN-QGZVFWFLSA-M
Molecular Weight 376.288 g/mol
SMILES S1([C@](CC(=C1C(=O)C)[O-])(c1ccc(cc1)Br)[H])c1ccccc1
SPLASH splash10-0096-0509000000-4b6a0b0a12300549b1bc
Source of Spectrum E1-38-333-6
Synonyms (1S,5R)-2-Acetyl-5-(4-bromo-phenyl)-1-phenyl-4,5-dihydro-1H-1lambda*4*-thiophen-3-ol anion (1R,5R)-2-acetyl-5-(4-bromophenyl)-1-phenyl-4,5-dihydro-1H-1lambda(4)-thiophen-3-olate cis-2-Acetyl-3-oxo-5-(4-bromophenyl)-1-phenylthiolane-2-ylide trans-2-Acetyl-3-oxo-5-(4-bromophenyl)-1-phenylthiolane-2-ylide
Wiley ID 1518148