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(+-)-(2.XI.)-2r-benzenesulfonylmethyl-3c-[(.XI.)-2,3-epoxy-propyl]-4,4-dimethyl-cyclohexanone ethane-1,2-diyl acetal
SpectraBase Compound ID 8PsgWUulTek
InChI InChI=1S/C20H28O5S/c1-19(2)8-9-20(24-10-11-25-20)18(17(19)12-15-13-23-15)14-26(21,22)16-6-4-3-5-7-16/h3-7,15,17-18H,8-14H2,1-2H3/t15?,17-,18+/m0/s1
InChIKey VGPWTSZXRCQYKK-XSRYCBBQSA-N
Mol Weight 380.5 g/mol
Molecular Formula C20H28O5S
Exact Mass 380.165745 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EspjMEIEsbK
Name (+-)-(2.XI.)-2r-benzenesulfonylmethyl-3c-[(.XI.)-2,3-epoxy-propyl]-4,4-dimethyl-cyclohexanone ethane-1,2-diyl acetal
CAS Registry Number 124094-18-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28O5S
InChI InChI=1S/C20H28O5S/c1-19(2)8-9-20(24-10-11-25-20)18(17(19)12-15-13-23-15)14-26(21,22)16-6-4-3-5-7-16/h3-7,15,17-18H,8-14H2,1-2H3/t15?,17-,18+/m0/s1
InChIKey VGPWTSZXRCQYKK-XSRYCBBQSA-N
Molecular Weight 380.499 g/mol
SMILES C(S(=O)(=O)c1ccccc1)[C@]1(C2(OCCO2)CCC([C@]1(CC1OC1)[H])(C)C)[H]
SPLASH splash10-052n-9120000000-d3c03d0253723872b075
Source of Spectrum F-45-667-17
Synonyms (+-)-(2.XI.)-2r-benzenesulfonylmethyl-3c-[(.XI.)-3c-[(.XI.)-2,3-epoxy-propyl]-4,4-dimethylcyclo-hexanone ethane-1,2-diyl acetal (6R,7S)-8,8-dimethyl-7-(2-oxiranylmethyl)-6-[(phenylsulfonyl)methyl]-1,4-dioxaspiro[4.5]decane [(6R,7S)-8,8-dimethyl-7-(2-oxiranylmethyl)-1,4-dioxaspiro[4.5]dec-6-yl]methyl phenyl sulfone
Wiley ID 1359670