Ethyl (2E,6S,7S)-8-Benzoyloxy-2,6-dimethyl-7-[(phenoxythiocarbonyl)oxy]-2-octenoate

SpectraBase Compound ID	BX64fcqAx5f
InChI	InChI=1S/C26H30O6S/c1-4-29-24(27)20(3)13-11-12-19(2)23(18-30-25(28)21-14-7-5-8-15-21)32-26(33)31-22-16-9-6-10-17-22/h5-10,13-17,19,23H,4,11-12,18H2,1-3H3/b20-13+/t19-,23+/m0/s1
InChIKey	RDXAKGDOBBVHHL-NHQKFMDNSA-N Google Search
Mol Weight	470.58 g/mol
Molecular Formula	C26H30O6S
Exact Mass	470.17631 g/mol

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SpectraBase Spectrum ID	GHCDeKVOkKt
Name	Ethyl (2E,6S,7S)-8-Benzoyloxy-2,6-dimethyl-7-[(phenoxythiocarbonyl)oxy]-2-octenoate
Alternate Name(s)	(2S,3S,6E)-8-ethoxy-3,7-dimethyl-8-oxo-2-[(phenoxycarbothioyl)oxy]-6-octenyl benzoate benzoic acid[(E,2S,3S)-8-ethoxy-3,7-dimethyl-8-oxo-2-[phenoxy(sulfanylidene)methoxy]oct-6-enyl]ester benzoic acid[(E,2S,3S)-8-ethoxy-8-keto-3,7-dimethyl-2-phenoxycarbothioyloxy-oct-6-enyl]ester [(E,2S,3S)-8-ethoxy-3,7-dimethyl-8-oxidanylidene-2-phenoxycarbothioyloxy-oct-6-enyl]benzoate [(E,2S,3S)-8-ethoxy-3,7-dimethyl-8-oxo-2-phenoxycarbothioyloxy-oct-6-enyl]benzoate benzoic acid [(E,2S,3S)-8-ethoxy-3,7-dimethyl-8-oxo-2-[phenoxy(sulfanylidene)methoxy]oct-6-enyl] ester [(E,2S,3S)-8-ethoxy-3,7-dimethyl-8-oxo-2-phenoxycarbothioyloxyoct-6-enyl] benzoate [(E,2S,3S)-8-ethoxy-3,7-dimethyl-8-oxo-2-phenoxycarbothioyloxy-oct-6-enyl] benzoate [(E,2S,3S)-8-ethoxy-3,7-dimethyl-8-oxidanylidene-2-phenoxycarbothioyloxy-oct-6-enyl] benzoate
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Formula	C26H30O6S
InChI	InChI=1S/C26H30O6S/c1-4-29-24(27)20(3)13-11-12-19(2)23(18-30-25(28)21-14-7-5-8-15-21)32-26(33)31-22-16-9-6-10-17-22/h5-10,13-17,19,23H,4,11-12,18H2,1-3H3/b20-13+/t19-,23+/m0/s1
InChIKey	RDXAKGDOBBVHHL-NHQKFMDNSA-N
Molecular Weight	470.580 g/mol
SMILES	C(O[C@](COC(=O)c1ccccc1)([C@](CC\C=C\(C(=O)OCC)C)(C)[H])[H])(=S)Oc1ccccc1
SPLASH	splash10-0adi-4900000000-ec31748e3062f463f48d
Source of Spectrum	K1-0-907-11
Wiley ID	1588414