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Butane, 4-(9-borabicyclo[3.3.1]non-9-yloxy)-1,1-bis(9-borabicyclo[3.3.1]non-9-ylthio)-
SpectraBase Compound ID Jmk21b11ChI
InChI InChI=1S/C28H49B3OS2/c1-8-22-10-2-11-23(9-1)29(22)32-21-7-20-28(33-30-24-12-3-13-25(30)15-4-14-24)34-31-26-16-5-17-27(31)19-6-18-26/h22-28H,1-21H2
InChIKey JTQJRVZSZPQSRZ-UHFFFAOYSA-N
Mol Weight 498.2 g/mol
Molecular Formula C28H49B3OS2
Exact Mass 498.350399 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6zQI9MNzP6h
Name Butane, 4-(9-borabicyclo[3.3.1]non-9-yloxy)-1,1-bis(9-borabicyclo[3.3.1]non-9-ylthio)-
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Formula C28H49B3OS2
InChI InChI=1S/C28H49B3OS2/c1-8-22-10-2-11-23(9-1)29(22)32-21-7-20-28(33-30-24-12-3-13-25(30)15-4-14-24)34-31-26-16-5-17-27(31)19-6-18-26/h22-28H,1-21H2
InChIKey JTQJRVZSZPQSRZ-UHFFFAOYSA-N
Molecular Weight 498.249 g/mol
SMILES C1CC2CCCC(B2SC(CCCOB2C3CCCC2CCC3)SB2C3CCCC2CCC3)C1
SPLASH splash10-000i-9320000000-998ee2e67b56fd23d51c
Synonyms 9-([4-(9-Borabicyclo[3.3.1]non-9-yloxy)-1-(9-borabicyclo[3.3.1]non-9-ylsulfanyl)butyl]sulfanyl)-9-borabicyclo[3.3.1]nonane 9-[4,4-bis(9-borabicyclo[3.3.1]nonan-9-ylsulfanyl)butoxy]-9-borabicyclo[3.3.1]nonane 9-[4,4-bis(9-borabicyclo[3.3.1]nonan-9-ylthio)butoxy]-9-borabicyclo[3.3.1]nonane
Wiley ID 1493896