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(exo)-9,10-Epithio-1.beta.-(chloroacetoxy)-4.beta.-methoxy-(octahydro)anthracene
SpectraBase Compound ID GWqmYPDC2N3
InChI InChI=1S/C17H19ClO3S/c1-20-11-6-7-12(21-13(19)8-18)15-14(11)16-9-4-2-3-5-10(9)17(15)22-16/h2-5,11-12,14-17H,6-8H2,1H3/t11-,12+,14?,15?,16-,17+/m0/s1
InChIKey OVHUMGXUQCOQGE-ZHNFGKFWSA-N
Mol Weight 338.85 g/mol
Molecular Formula C17H19ClO3S
Exact Mass 338.074343 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ELQMOS0lD2x
Name (exo)-9,10-Epithio-1.beta.-(chloroacetoxy)-4.beta.-methoxy-(octahydro)anthracene
Comments Less than 3 mono-isotopic peaks
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Formula C17H19ClO3S
InChI InChI=1S/C17H19ClO3S/c1-20-11-6-7-12(21-13(19)8-18)15-14(11)16-9-4-2-3-5-10(9)17(15)22-16/h2-5,11-12,14-17H,6-8H2,1H3/t11-,12+,14?,15?,16-,17+/m0/s1
InChIKey OVHUMGXUQCOQGE-ZHNFGKFWSA-N
Molecular Weight 338.849 g/mol
SMILES C12[C@@]3(S[C@](C2[C@@](OC)(CC[C@]1(OC(=O)CCl)[H])[H])(c1ccccc31)[H])[H]
SPLASH splash10-001i-0900000000-5b6a8ebd258fbd7bd9c7
Source of Spectrum D8-324-436-8
Wiley ID 1514096