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(7S,9S)-10-(1',3'-dithian-2'-yl)-7,9-isopropylidenedioxy-2,4-dimethyl-5-(phenylsulfonyl)decan-4-ol
SpectraBase Compound ID 7BnlPs9CS2h
InChI InChI=1S/C25H40O5S3/c1-18(2)17-25(5,26)22(33(27,28)21-10-7-6-8-11-21)15-19-14-20(30-24(3,4)29-19)16-23-31-12-9-13-32-23/h6-8,10-11,18-20,22-23,26H,9,12-17H2,1-5H3/t19-,20-,22?,25?/m0/s1
InChIKey UFEFNOFEHPVRIY-NHJJBMEFSA-N
Mol Weight 516.8 g/mol
Molecular Formula C25H40O5S3
Exact Mass 516.203788 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6b4i1utRG3l
Name (7S,9S)-10-(1',3'-dithian-2'-yl)-7,9-isopropylidenedioxy-2,4-dimethyl-5-(phenylsulfonyl)decan-4-ol
Alternate Name(s) 1-[(4S,6S)-6-(1,3-dithian-2-ylmethyl)-2,2-dimethyl-1,3-dioxan-4-yl]-3,5-dimethyl-2-(phenylsulfonyl)-3-hexanol
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Formula C25H40O5S3
InChI InChI=1S/C25H40O5S3/c1-18(2)17-25(5,26)22(33(27,28)21-10-7-6-8-11-21)15-19-14-20(30-24(3,4)29-19)16-23-31-12-9-13-32-23/h6-8,10-11,18-20,22-23,26H,9,12-17H2,1-5H3/t19-,20-,22?,25?/m0/s1
InChIKey UFEFNOFEHPVRIY-NHJJBMEFSA-N
Molecular Weight 516.770 g/mol
SMILES OC(C(S(=O)(=O)c1ccccc1)C[C@]1(OC(C)(C)O[C@@](C1)(CC1SCCCS1)[H])[H])(CC(C)C)C
SPLASH splash10-0b90-0900900000-59983b6a1410df5ee28f
Source of Spectrum KC-1993-1515-42
Wiley ID 778159