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(+-)-6t-hydroxy-4,4-dimethyl-8c-phenylsulfanyl-(4ar,8at)-octahydro-naphthalen-1-one ethane-1,2-diyl acetal
SpectraBase Compound ID DtFgnUBwkqs
InChI InChI=1S/C20H28O3S/c1-19(2)8-9-20(22-10-11-23-20)18-16(19)12-14(21)13-17(18)24-15-6-4-3-5-7-15/h3-7,14,16-18,21H,8-13H2,1-2H3/t14-,16+,17+,18-/m0/s1
InChIKey QDHIUNKUUQZUGU-HPBDAGMYSA-N
Mol Weight 348.5 g/mol
Molecular Formula C20H28O3S
Exact Mass 348.175916 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KBxGWvz180T
Name (+-)-6t-hydroxy-4,4-dimethyl-8c-phenylsulfanyl-(4ar,8at)-octahydro-naphthalen-1-one ethane-1,2-diyl acetal
CAS Registry Number 124094-22-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28O3S
InChI InChI=1S/C20H28O3S/c1-19(2)8-9-20(22-10-11-23-20)18-16(19)12-14(21)13-17(18)24-15-6-4-3-5-7-15/h3-7,14,16-18,21H,8-13H2,1-2H3/t14-,16+,17+,18-/m0/s1
InChIKey QDHIUNKUUQZUGU-HPBDAGMYSA-N
Molecular Weight 348.501 g/mol
SMILES O[C@@]1(C[C@]([C@@]2([C@](C(C)(C)CCC22OCCO2)(C1)[H])[H])(Sc1ccccc1)[H])[H]
SPLASH splash10-000b-9152000000-ec6af51150e0be2184d3
Source of Spectrum F-45-669-21
Synonyms (4'aR,6'S,8'R,8'aR)-4',4'-dimethyl-8'-(phenylsulfanyl)-octahydro-2'H-spiro[1,3-dioxolane-2,1'-naphthalene]-6'-ol
Wiley ID 1340691