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6-(1,3-Dithian-2-ylidenemethyl)-3a,6-dimethyl-7-(2-oxopropyl)dodecahydro-1H-cyclopenta[a]naphthalen-3-yl acetate
SpectraBase Compound ID 1MyUo8LGYug
InChI InChI=1S/C25H38O3S2/c1-16(26)14-18-6-7-19-20-8-9-22(28-17(2)27)24(20,3)11-10-21(19)25(18,4)15-23-29-12-5-13-30-23/h15,18-22H,5-14H2,1-4H3
InChIKey IRQSZQRCQVGXGM-UHFFFAOYSA-N
Mol Weight 450.7 g/mol
Molecular Formula C25H38O3S2
Exact Mass 450.226237 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 88xHuq0de7V
Name 6-(1,3-Dithian-2-ylidenemethyl)-3a,6-dimethyl-7-(2-oxopropyl)dodecahydro-1H-cyclopenta[a]naphthalen-3-yl acetate
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Formula C25H38O3S2
InChI InChI=1S/C25H38O3S2/c1-16(26)14-18-6-7-19-20-8-9-22(28-17(2)27)24(20,3)11-10-21(19)25(18,4)15-23-29-12-5-13-30-23/h15,18-22H,5-14H2,1-4H3
InChIKey IRQSZQRCQVGXGM-UHFFFAOYSA-N
Molecular Weight 450.696 g/mol
SMILES CC(=O)CC1CCC2C(CCC3(C2CCC3OC(=O)C)C)C1(C=C1SCCCS1)C
SPLASH splash10-052f-8932100000-6afb98956b08533c3f17
Synonyms Acetic acid, 6-[1,3]dithian-2-ylidenemethyl-3a,6-dimethyl-7-(2-oxopropyl)-dodecahydrocyclopenta[a]naphthalen-3-yl ester Acetic acid [6-(1,3-dithian-2-ylidenemethyl)-3a,6-dimethyl-7-(2-oxopropyl)-2,3,4,5,5a,7,8,9,9a,9b-decahydro-1H-cyclopenta[a]naphthalen-3-yl] ester [6-(1,3-dithian-2-ylidenemethyl)-3a,6-dimethyl-7-(2-oxopropyl)-2,3,4,5,5a,7,8,9,9a,9b-decahydro-1H-cyclopenta[a]naphthalen-3-yl] acetate [7-acetonyl-6-(1,3-dithian-2-ylidenemethyl)-3a,6-dimethyl-2,3,4,5,5a,7,8,9,9a,9b-decahydro-1H-cyclopenta[a]naphthalen-3-yl] acetate [6-(1,3-dithian-2-ylidenemethyl)-3a,6-dimethyl-7-(2-oxidanylidenepropyl)-2,3,4,5,5a,7,8,9,9a,9b-decahydro-1H-cyclopenta[a]naphthalen-3-yl] ethanoate
Wiley ID 1488178