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Bis[(3S,7R,11R)-3,7,11,15-tetramethyl-1-hexadecyl] Sulfide
SpectraBase Compound ID dTu2mOfXcV
InChI InChI=1S/C40H82S/c1-33(2)17-11-19-35(5)21-13-23-37(7)25-15-27-39(9)29-31-41-32-30-40(10)28-16-26-38(8)24-14-22-36(6)20-12-18-34(3)4/h33-40H,11-32H2,1-10H3/t35-,36-,37-,38-,39+,40+/m1/s1
InChIKey YPHCCGNQTHPSPY-JGPPEONJSA-N
Mol Weight 595.2 g/mol
Molecular Formula C40H82S
Exact Mass 594.613724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J7yW7rWnPG7
Name Bis[(3S,7R,11R)-3,7,11,15-tetramethyl-1-hexadecyl] Sulfide
Comments Less than 3 mono-isotopic peaks
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Formula C40H82S
InChI InChI=1S/C40H82S/c1-33(2)17-11-19-35(5)21-13-23-37(7)25-15-27-39(9)29-31-41-32-30-40(10)28-16-26-38(8)24-14-22-36(6)20-12-18-34(3)4/h33-40H,11-32H2,1-10H3/t35-,36-,37-,38-,39+,40+/m1/s1
InChIKey YPHCCGNQTHPSPY-JGPPEONJSA-N
Molecular Weight 595.156 g/mol
SMILES C(SCC[C@](CCC[C@@](CCC[C@@](CCCC(C)C)(C)[H])(C)[H])(C)[H])C[C@](CCC[C@@](CCC[C@@](CCCC(C)C)(C)[H])(C)[H])(C)[H]
SPLASH splash10-01ot-0005090000-3682b44651e7d1b0ef62
Source of Spectrum J-58-5287-5
Synonyms (3S,7R,11R)-3,7,11,15-tetramethyl-1-{[(3S,7R,11R)-3,7,11,15-tetramethylhexadecyl]sulfanyl}hexadecane bis[(3S,7R,11R)-3,7,11,15-tetramethylhexadecyl]sulfide
Wiley ID 1409709