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(1 S / R)-1-[2'-(Methoxycarbonyl)vinyl]-3a-hydroxy-7a-methyl-5-spiro[2'-(1'',3'-dithiacyclohexano)]bicyclo[4.3.0]nonane
SpectraBase Compound ID Gc9dClCFtYN
InChI InChI=1S/C17H26O3S2/c1-15-8-9-17(21-10-3-11-22-17)12-16(15,19)7-6-13(15)4-5-14(18)20-2/h4-5,13,19H,3,6-12H2,1-2H3/b5-4-/t13-,15+,16-/m0/s1
InChIKey PSBAOYYJFPVOPT-SKTCHFKMSA-N
Mol Weight 342.51 g/mol
Molecular Formula C17H26O3S2
Exact Mass 342.132337 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9pVPjENwuZ8
Name (1 S / R)-1-[2'-(Methoxycarbonyl)vinyl]-3a-hydroxy-7a-methyl-5-spiro[2'-(1'',3'-dithiacyclohexano)]bicyclo[4.3.0]nonane
Alternate Name(s) (1 R / S)-1-[2'-(Methoxycarbonyl)vinyl]-3a-hydroxy-7a-methyl-5-spiro[2'-(1'',3'-dithiacyclohexano)]bicyclo[4.3.0]nonane
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Formula C17H26O3S2
InChI InChI=1S/C17H26O3S2/c1-15-8-9-17(21-10-3-11-22-17)12-16(15,19)7-6-13(15)4-5-14(18)20-2/h4-5,13,19H,3,6-12H2,1-2H3/b5-4-/t13-,15+,16-/m0/s1
InChIKey PSBAOYYJFPVOPT-SKTCHFKMSA-N
Molecular Weight 342.512 g/mol
SMILES O[C@@]12[C@](CCC3(C2)SCCCS3)([C@@](\C=C/C(=O)OC)(CC1)[H])C
SPLASH splash10-06si-0902000000-310c6a157c346e9d097d
Source of Spectrum Y4-91-93-7
Wiley ID 840662