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VIRGATUSIN;(-)-7,8-CIS-8,8'-TRANS-7',8'-TRANS-7-[3,4-(METHYLENEDIOXY)-PHENYL]-7'-(3',4'-DIMETHOXYPHENYL)-8,8-BIS-(METHOXYMETHYL)-TETRAHYDROFURANE

View entire compound with spectra: 1 NMR, and 1 MS (GC)

VIRGATUSIN;(-)-7,8-CIS-8,8'-TRANS-7',8'-TRANS-7-[3,4-(METHYLENEDIOXY)-PHENYL]-7'-(3',4'-DIMETHOXYPHENYL)-8,8-BIS-(METHOXYMETHYL)-TETRAHYDROFURANE
SpectraBase Compound ID 4u71pEIPtY5
InChI InChI=1S/C23H28O7/c1-24-11-16-17(12-25-2)23(15-6-8-19-21(10-15)29-13-28-19)30-22(16)14-5-7-18(26-3)20(9-14)27-4/h5-10,16-17,22-23H,11-13H2,1-4H3/t16-,17-,22+,23-/m1/s1
InChIKey OGTJJRNJLHLKFF-ROEJJBDBSA-N
Mol Weight 416.47 g/mol
Molecular Formula C23H28O7
Exact Mass 416.183503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID SPNMjQWrg
Name 5-[(2S,3S,4S,5R)-5-(3,4-dimethoxyphenyl)-3,4-bis(methoxymethyl)-2-oxolanyl]-1,3-benzodioxole
Alternate Name(s) 5-[(2S,3S,4S,5R)-5-(3,4-dimethoxyphenyl)-3,4-bis(methoxymethyl)oxolan-2-yl]-1,3-benzodioxole 5-[(2S,3S,4S,5R)-5-(3,4-dimethoxyphenyl)-3,4-bis(methoxymethyl)tetrahydrofuran-2-yl]-1,3-benzodioxole
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Formula C23H28O7
InChI InChI=1S/C23H28O7/c1-24-11-16-17(12-25-2)23(15-6-8-19-21(10-15)29-13-28-19)30-22(16)14-5-7-18(26-3)20(9-14)27-4/h5-10,16-17,22-23H,11-13H2,1-4H3/t16-,17-,22+,23-/m1/s1
InChIKey OGTJJRNJLHLKFF-ROEJJBDBSA-N
Molecular Weight 416.470 g/mol
SMILES [C@]1(O[C@]([C@@]([C@]1(COC)[H])(COC)[H])(c1cc(OC)c(cc1)OC)[H])(c1cc2OCOc2cc1)[H]
SPLASH splash10-01bi-0930500000-c40406c39f3d4c2139d8
Source of Spectrum G4-59-521-1
Wiley ID 1606345