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(5R,6S)-5-(2-Butyl-1,3-dithian-2-yl)-6,7-dihydro-6-phenyl-5H-indeno[5,6-d]-1,3-dioxole

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(5R,6S)-5-(2-Butyl-1,3-dithian-2-yl)-6,7-dihydro-6-phenyl-5H-indeno[5,6-d]-1,3-dioxole
SpectraBase Compound ID JtYYwPwVJIv
InChI InChI=1S/C24H28O2S2/c1-2-3-10-24(27-11-7-12-28-24)23-19(17-8-5-4-6-9-17)13-18-14-21-22(15-20(18)23)26-16-25-21/h4-6,8-9,14-15,19,23H,2-3,7,10-13,16H2,1H3/t19-,23-/m1/s1
InChIKey GADCJUQNNXHMDF-AUSIDOKSSA-N
Mol Weight 412.61 g/mol
Molecular Formula C24H28O2S2
Exact Mass 412.153072 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9J3ks0AYuXT
Name (5R,6S)-5-(2-Butyl-1,3-dithian-2-yl)-6,7-dihydro-6-phenyl-5H-indeno[5,6-d]-1,3-dioxole
Alternate Name(s) (5R,6S)-5-(2-butyl-1,3-dithian-2-yl)-6-phenyl-6,7-dihydro-5H-indeno[5,6-d][1,3]dioxole trans-5-(2-Butyl-1,3-dithian-2-yl)-6,7-dihydro-6-phenyl-5H-indeno[5,6-d]-1,3-dioxole
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Formula C24H28O2S2
InChI InChI=1S/C24H28O2S2/c1-2-3-10-24(27-11-7-12-28-24)23-19(17-8-5-4-6-9-17)13-18-14-21-22(15-20(18)23)26-16-25-21/h4-6,8-9,14-15,19,23H,2-3,7,10-13,16H2,1H3/t19-,23-/m1/s1
InChIKey GADCJUQNNXHMDF-AUSIDOKSSA-N
Molecular Weight 412.606 g/mol
SMILES c12[C@@]([C@@](c3ccccc3)(Cc1cc1c(c2)OCO1)[H])(C1(SCCCS1)CCCC)[H]
SPLASH splash10-004r-0910000000-a2a24c79d95296c0aa53
Source of Spectrum F-52-14959-23
Wiley ID 799757