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8.pha.,13-Epoxylabdane-2.beta.,20-diyl Sulfite

View entire compound with spectra: 1 MS (GC)

8.pha.,13-Epoxylabdane-2.beta.,20-diyl Sulfite
SpectraBase Compound ID DzyZwKOXE9u
InChI InChI=1S/C20H34O4S/c1-6-18(4)9-7-16-19(5,24-18)10-8-15-17(2,3)11-14-12-20(15,16)13-22-25(21)23-14/h14-16H,6-13H2,1-5H3/t14-,15+,16?,18+,19-,20-,25?/m1/s1
InChIKey JTYVYXXSYKEHCX-SGDULHOSSA-N
Mol Weight 370.5 g/mol
Molecular Formula C20H34O4S
Exact Mass 370.217781 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8bHlvtZFobZ
Name 8.pha.,13-Epoxylabdane-2.beta.,20-diyl Sulfite
Alternate Name(s) (1R,2R,5S,7S,10S,13S)-5-ethyl-5,7,11,11-tetramethyl-6,14,16-trioxa-15-thiatetracyclo[11.4.1.0(1,10).0(2,7)]octadecane 15-oxide 8.alpha.,13-Epoxylabdane-2.beta.,20-diyl Sulfite 8a,13-epoxylabdane-2b,20-diyl sulfite
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Formula C20H34O4S
InChI InChI=1S/C20H34O4S/c1-6-18(4)9-7-16-19(5,24-18)10-8-15-17(2,3)11-14-12-20(15,16)13-22-25(21)23-14/h14-16H,6-13H2,1-5H3/t14-,15+,16?,18+,19-,20-,25?/m1/s1
InChIKey JTYVYXXSYKEHCX-SGDULHOSSA-N
Molecular Weight 370.548 g/mol
SMILES [C@]123C4[C@@](O[C@](CC4)(CC)C)(C)CC[C@]1(C(C)(C)C[C@@](OS(OC2)=O)(C3)[H])[H]
SPLASH splash10-056r-0091000000-a378bc0dad2339c238a2
Source of Spectrum B-44-487-0
Wiley ID 1354260