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Saucerneol B

View entire compound with spectra: 1 MS (GC)

Saucerneol B
SpectraBase Compound ID ElukqqfEJg1
InChI InChI=1S/C31H36O8/c1-17-18(2)31(39-30(17)21-8-10-23(33-4)26(14-21)34-5)22-9-12-25(27(15-22)35-6)38-19(3)29(32)20-7-11-24-28(13-20)37-16-36-24/h7-15,17-19,29-32H,16H2,1-6H3/t17-,18+,19?,29?,30+,31-/m0/s1
InChIKey HVQJVSACIKTWQR-HZFJSAMJSA-N
Mol Weight 536.6 g/mol
Molecular Formula C31H36O8
Exact Mass 536.241018 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID qpjm3zrkNN
Name Saucerneol B
Alternate Name(s) 1-(1,3-benzodioxol-5-yl)-2-[4-[(2S,3R,4S,5R)-5-(3,4-dimethoxyphenyl)-3,4-dimethyl-2-oxolanyl]-2-methoxyphenoxy]-1-propanol 1-(1,3-benzodioxol-5-yl)-2-[4-[(2S,3R,4S,5R)-5-(3,4-dimethoxyphenyl)-3,4-dimethyloxolan-2-yl]-2-methoxyphenoxy]propan-1-ol 1-(1,3-benzodioxol-5-yl)-2-[4-[(2S,3R,4S,5R)-5-(3,4-dimethoxyphenyl)-3,4-dimethyl-oxolan-2-yl]-2-methoxy-phenoxy]propan-1-ol
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Formula C31H36O8
InChI InChI=1S/C31H36O8/c1-17-18(2)31(39-30(17)21-8-10-23(33-4)26(14-21)34-5)22-9-12-25(27(15-22)35-6)38-19(3)29(32)20-7-11-24-28(13-20)37-16-36-24/h7-15,17-19,29-32H,16H2,1-6H3/t17-,18+,19?,29?,30+,31-/m0/s1
InChIKey HVQJVSACIKTWQR-HZFJSAMJSA-N
Molecular Weight 536.621 g/mol
SMILES OC(c1cc2OCOc2cc1)C(Oc1ccc([C@]2(O[C@]([C@@](C)([C@]2(C)[H])[H])(c2cc(OC)c(cc2)OC)[H])[H])cc1OC)C
SPLASH splash10-00n4-0902060000-f6c8455680952f466deb
Source of Spectrum E2-49-1193-5
Wiley ID 1555728