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1,3-dibromo-5-cyclohexylthieno[3,4-c]phosphole-4,6-dione
SpectraBase Compound ID FBh7XhQkNck
InChI InChI=1S/C12H11Br2O2PS/c13-9-7-8(10(14)18-9)12(16)17(11(7)15)6-4-2-1-3-5-6/h6H,1-5H2
InChIKey BRDSRYBOSSJGBX-UHFFFAOYSA-N
Mol Weight 410.06 g/mol
Molecular Formula C12H11Br2O2PS
Exact Mass 407.858414 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HLuxClDxwlh
Name 1,3-dibromo-5-cyclohexylthieno[3,4-c]phosphole-4,6-dione
Appearance Pale yellow solid
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Exact Mass 407.858413764 u
Formula C12H11Br2O2PS
InChI InChI=1S/C12H11Br2O2PS/c13-9-7-8(10(14)18-9)12(16)17(11(7)15)6-4-2-1-3-5-6/h6H,1-5H2
InChIKey BRDSRYBOSSJGBX-UHFFFAOYSA-N
Instrument Name JEOL JMS-DX303HF or JEOL TMS-700
Ionization Type EI
Literature Reference DOI 10.1002/chem.201602392
Molecular Weight 410.060 g/mol
Quality 280
Reported Formula C12H11Br2O2PS
SMILES C1(P(C(C=2C1=C(SC2Br)Br)=O)C1CCCCC1)=O
SPLASH splash10-004i-1209200000-fe34af89838549e08013
Source of Spectrum QE-22-SM11-Cy-2 (DOI: 10.1002/chem.201602392)
Thin-Layer Chromatography 0.75 (CH2Cl2)
Wiley ID 1903554