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(1S,4S,5S,6R)-6-(Methoxymethyl)oxy-4-{[(4'-methoxyphenyl)methyl]oxy}methyl-1-(phenylsulfonyl)-3-oxabicyclo[3.3.0]octane-2-one
SpectraBase Compound ID 5ZrMtkef8Vr
InChI InChI=1S/C24H28O8S/c1-28-16-31-20-12-13-24(33(26,27)19-6-4-3-5-7-19)22(20)21(32-23(24)25)15-30-14-17-8-10-18(29-2)11-9-17/h3-11,20-22H,12-16H2,1-2H3/t20-,21-,22+,24+/m1/s1
InChIKey WRKPWBUXGJHEHO-SVPADUAOSA-N
Mol Weight 476.54 g/mol
Molecular Formula C24H28O8S
Exact Mass 476.150489 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BPZYFxC6ZRE
Name (1S,4S,5S,6R)-6-(Methoxymethyl)oxy-4-{[(4'-methoxyphenyl)methyl]oxy}methyl-1-(phenylsulfonyl)-3-oxabicyclo[3.3.0]octane-2-one
Alternate Name(s) (3S,3aS,4R,6aS)-3-{[(4-methoxybenzyl)oxy]methyl}-4-(methoxymethoxy)-6a-(phenylsulfonyl)hexahydro-1H-cyclopenta[c]furan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H28O8S
InChI InChI=1S/C24H28O8S/c1-28-16-31-20-12-13-24(33(26,27)19-6-4-3-5-7-19)22(20)21(32-23(24)25)15-30-14-17-8-10-18(29-2)11-9-17/h3-11,20-22H,12-16H2,1-2H3/t20-,21-,22+,24+/m1/s1
InChIKey WRKPWBUXGJHEHO-SVPADUAOSA-N
Molecular Weight 476.540 g/mol
SMILES [C@]12(S(=O)(=O)c3ccccc3)C(O[C@@]([C@@]1([C@](OCOC)(CC2)[H])[H])(COCc1ccc(cc1)OC)[H])=O
SPLASH splash10-00e9-0900700000-7fea83d72044f15d1dfb
Source of Spectrum F-56-8090-0
Wiley ID 858930