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(1R,3R)-1-Methoxymethoxy-3-[(1S,2R,4R)-2-hydroxybornane-10-sulfenyl]-1,3-diphenylpropane
SpectraBase Compound ID Fc18XAtu3FE
InChI InChI=1S/C27H36O3S/c1-26(2)22-14-15-27(26,25(28)16-22)18-31-24(21-12-8-5-9-13-21)17-23(30-19-29-3)20-10-6-4-7-11-20/h4-13,22-25,28H,14-19H2,1-3H3/t22-,23-,24-,25-,27-/m1/s1
InChIKey SRFLESRYGQESNF-CXTGUETESA-N
Mol Weight 440.6 g/mol
Molecular Formula C27H36O3S
Exact Mass 440.238516 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 62vVBdrQHLV
Name (1R,3R)-1-Methoxymethoxy-3-[(1S,2R,4R)-2-hydroxybornane-10-sulfenyl]-1,3-diphenylpropane
Alternate Name(s) (1S,2R,4R)-1-({[(1R,3R)-3-(methoxymethoxy)-1,3-diphenylpropyl]sulfanyl}methyl)-7,7-dimethylbicyclo[2.2.1]heptan-2-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H36O3S
InChI InChI=1S/C27H36O3S/c1-26(2)22-14-15-27(26,25(28)16-22)18-31-24(21-12-8-5-9-13-21)17-23(30-19-29-3)20-10-6-4-7-11-20/h4-13,22-25,28H,14-19H2,1-3H3/t22-,23-,24-,25-,27-/m1/s1
InChIKey SRFLESRYGQESNF-CXTGUETESA-N
Molecular Weight 440.642 g/mol
SMILES O[C@@]1(C[C@]2(CC[C@@]1(C2(C)C)CS[C@](C[C@](c1ccccc1)(OCOC)[H])(c1ccccc1)[H])[H])[H]
SPLASH splash10-0a5c-3910000000-9a6aa223f85935dcc283
Source of Spectrum KD-16-904-7
Wiley ID 1636926