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(7R,8R,13R,14R)-7,14,17,17,18,18-Hexamethyl-9,10,11,12-tetrathiapentacyclo[12.2.1.1(4,7).0(2,13).0(3,8)]octadecane
SpectraBase Compound ID GrI3FbMHZtt
InChI InChI=1S/C20H32S4/c1-17(2)11-7-9-19(17,5)15-13(11)14-12-8-10-20(6,18(12,3)4)16(14)22-24-23-21-15/h11-16H,7-10H2,1-6H3/t11-,12+,13?,14?,15-,16-,19+,20+/m1/s1
InChIKey RGOIRZGYTFSNND-YAIQRYQRSA-N
Mol Weight 400.7 g/mol
Molecular Formula C20H32S4
Exact Mass 400.138686 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Eg1LFsrST1P
Name (7R,8R,13R,14R)-7,14,17,17,18,18-Hexamethyl-9,10,11,12-tetrathiapentacyclo[12.2.1.1(4,7).0(2,13).0(3,8)]octadecane
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Formula C20H32S4
InChI InChI=1S/C20H32S4/c1-17(2)11-7-9-19(17,5)15-13(11)14-12-8-10-20(6,18(12,3)4)16(14)22-24-23-21-15/h11-16H,7-10H2,1-6H3/t11-,12+,13?,14?,15-,16-,19+,20+/m1/s1
InChIKey RGOIRZGYTFSNND-YAIQRYQRSA-N
Molecular Weight 400.716 g/mol
SMILES [C@]12([C@]3(C(C4[C@@]([C@@]5(C)C([C@]4(CC5)[H])(C)C)([H])SSSS3)[C@](C2(C)C)(CC1)[H])[H])C
SPLASH splash10-0ukc-0349000000-1e22ceccc273d53963fb
Source of Spectrum H1-51-510-8
Wiley ID 816981