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2-[(2S,3S,3aR,5aS,9aS,9bR)-3-[(E)-2-methoxyvinyl]-2,3a,6,6,9a-pentamethyl-3,4,5,5a,7,8,9,9b-octahydro-1H-cyclopenta[a]naphthalen-2-yl]-1,3-dithiolane
SpectraBase Compound ID 70EJTGZKE0
InChI InChI=1S/C24H40OS2/c1-21(2)10-7-11-22(3)17(21)8-12-23(4)18(9-13-25-6)24(5,16-19(22)23)20-26-14-15-27-20/h9,13,17-20H,7-8,10-12,14-16H2,1-6H3/b13-9+/t17-,18-,19+,22-,23-,24-/m0/s1
InChIKey UKBOUBTVPKPODS-JMAIPXRLSA-N
Mol Weight 408.7 g/mol
Molecular Formula C24H40OS2
Exact Mass 408.252058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3mSkr1AqJk2
Name 2-[(2S,3S,3aR,5aS,9aS,9bR)-3-[(E)-2-methoxyvinyl]-2,3a,6,6,9a-pentamethyl-3,4,5,5a,7,8,9,9b-octahydro-1H-cyclopenta[a]naphthalen-2-yl]-1,3-dithiolane
Alternate Name(s) 2-[(2S,3S,3aR,5aS,9aS,9bR)-3-[(E)-2-methoxyethenyl]-2,3a,6,6,9a-pentamethyl-3,4,5,5a,7,8,9,9b-octahydro-1H-cyclopenta[a]naphthalen-2-yl]-1,3-dithiolane (E/Z)-15a-homo-13S-11(12-13)-abeo-12-Ethylenedithia-15,15a-ene-15-methoxyisoanticopalane
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Formula C24H40OS2
InChI InChI=1S/C24H40OS2/c1-21(2)10-7-11-22(3)17(21)8-12-23(4)18(9-13-25-6)24(5,16-19(22)23)20-26-14-15-27-20/h9,13,17-20H,7-8,10-12,14-16H2,1-6H3/b13-9+/t17-,18-,19+,22-,23-,24-/m0/s1
InChIKey UKBOUBTVPKPODS-JMAIPXRLSA-N
Molecular Weight 408.703 g/mol
SMILES [C@]12([C@@]([C@]3(CCCC([C@@]3(CC2)[H])(C)C)C)(C[C@@]([C@]1(\C=C\OC)[H])(C1SCCS1)C)[H])C
SPLASH splash10-0a4i-0963200000-805a95173b2b8f62d31b
Source of Spectrum C5-2002-1527-7
Wiley ID 1614779