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Diiodophyllanthin

View entire compound with spectra: 1 MS (GC)

Diiodophyllanthin
SpectraBase Compound ID J9R49PW8EaG
InChI InChI=1S/C24H32I2O6/c1-27-19-9-7-15(13-21(19)29-3)11-17(23(25)31-5)18(24(26)32-6)12-16-8-10-20(28-2)22(14-16)30-4/h7-10,13-14,17-18,23-24H,11-12H2,1-6H3/t17-,18-,23?,24?/m1/s1
InChIKey AHCOJBOLSDWTIP-RDNZODCXSA-N
Mol Weight 670.3 g/mol
Molecular Formula C24H32I2O6
Exact Mass 670.028829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GCyEZJziWJ0
Name Diiodophyllanthin
Alternate Name(s) 4-{(2R,3R)-3-(3,4-dimethoxybenzyl)-4-iodo-2-[iodo(methoxy)methyl]-4-methoxybutyl}-1,2-dimethoxybenzene
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Formula C24H32I2O6
InChI InChI=1S/C24H32I2O6/c1-27-19-9-7-15(13-21(19)29-3)11-17(23(25)31-5)18(24(26)32-6)12-16-8-10-20(28-2)22(14-16)30-4/h7-10,13-14,17-18,23-24H,11-12H2,1-6H3/t17-,18-,23?,24?/m1/s1
InChIKey AHCOJBOLSDWTIP-RDNZODCXSA-N
Molecular Weight 670.323 g/mol
SMILES [C@]([C@](C(I)OC)(Cc1cc(OC)c(cc1)OC)[H])(C(I)OC)(Cc1cc(OC)c(cc1)OC)[H]
SPLASH splash10-0f92-9740000000-0acc474e978c80c5fced
Source of Spectrum F-47-8280-7
Wiley ID 1413902