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(3R,4S)-4-[(R)-1-(1,3-Benzodioxol-5-yl)-1-hydroxymethyl]-3-[(R)-1-(1,3-dimethoxyphenyl)-1-hydroxymethyl]tetrahydro-2-furanone
SpectraBase Compound ID Kyp8L7BtLLV
InChI InChI=1S/C21H22O8/c1-25-14-5-3-12(7-16(14)26-2)20(23)18-13(9-27-21(18)24)19(22)11-4-6-15-17(8-11)29-10-28-15/h3-8,13,18-20,22-23H,9-10H2,1-2H3/t13-,18-,19+,20+/m1/s1
InChIKey FRICVMNKEUYOFO-YFMMTPMMSA-N
Mol Weight 402.4 g/mol
Molecular Formula C21H22O8
Exact Mass 402.131468 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BHt8SRQmcEA
Name (3R,4S)-4-[(R)-1-(1,3-Benzodioxol-5-yl)-1-hydroxymethyl]-3-[(R)-1-(1,3-dimethoxyphenyl)-1-hydroxymethyl]tetrahydro-2-furanone
Alternate Name(s) (3R,4S)-4-[(R)-1-(1,3-Benzodioxol-5-yl)-1-hydroxymethyl]-3-[(R)-1-(3,4-dimethoxyphenyl)-1-hydroxymethyl]tetrahydro-2-furanone
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Formula C21H22O8
InChI InChI=1S/C21H22O8/c1-25-14-5-3-12(7-16(14)26-2)20(23)18-13(9-27-21(18)24)19(22)11-4-6-15-17(8-11)29-10-28-15/h3-8,13,18-20,22-23H,9-10H2,1-2H3/t13-,18-,19+,20+/m1/s1
InChIKey FRICVMNKEUYOFO-YFMMTPMMSA-N
Molecular Weight 402.399 g/mol
SMILES O[C@]([C@]1([C@]([C@](c2cc(OC)c(cc2)OC)(O)[H])(C(OC1)=O)[H])[H])(c1cc2OCOc2cc1)[H]
SPLASH splash10-014i-4900000000-21a99619bb7e3c4ea35c
Source of Spectrum SO-0-518-11
Wiley ID 879078