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(1S,3S)-5-Benzyloxy-6,8-dimethoxy-1,3-dimethylisochroman
SpectraBase Compound ID At6YIPYt9wC
InChI InChI=1S/C20H24O4/c1-13-10-16-19(14(2)24-13)17(21-3)11-18(22-4)20(16)23-12-15-8-6-5-7-9-15/h5-9,11,13-14H,10,12H2,1-4H3/t13-,14-/m0/s1
InChIKey WGCFEKXRWYIUPT-KBPBESRZSA-N
Mol Weight 328.41 g/mol
Molecular Formula C20H24O4
Exact Mass 328.167459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BRKG38utYBM
Name (1S,3S)-5-Benzyloxy-6,8-dimethoxy-1,3-dimethylisochroman
Alternate Name(s) (1S,3S)-5-(benzyloxy)-6,8-dimethoxy-1,3-dimethyl-3,4-dihydro-1H-2-benzopyran 5-Benzyloxy-6,8-dimethoxy-trans-1,3-dimethylisochromane
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Formula C20H24O4
InChI InChI=1S/C20H24O4/c1-13-10-16-19(14(2)24-13)17(21-3)11-18(22-4)20(16)23-12-15-8-6-5-7-9-15/h5-9,11,13-14H,10,12H2,1-4H3/t13-,14-/m0/s1
InChIKey WGCFEKXRWYIUPT-KBPBESRZSA-N
Molecular Weight 328.408 g/mol
SMILES c12c(c(OCc3ccccc3)c(cc1OC)OC)C[C@@](O[C@]2(C)[H])(C)[H]
SPLASH splash10-000f-1981000000-ac03fd28c378cdfed286
Source of Spectrum KC-0-803-25
Wiley ID 830193