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3-Isopropenyl-1,8,10b-trimethoxy-14-methyl-1,2,3,4,4a,4b,5,6,10b,14,14a-undecahydro-11-oxabenzo[3,4]cycloocta[1,2-a]naphthalene
SpectraBase Compound ID IsgxJpeqN4b
InChI InChI=1S/C31H36O3/c1-20(2)23-18-27-26-13-11-22-17-24(32-4)12-14-25(22)30(26)34-28(21-9-7-6-8-10-21)15-16-31(27,3)29(19-23)33-5/h6-10,12,14-15,17,23,27,29H,1,11,13,16,18-19H2,2-5H3/b28-15-/t23-,27+,29?,31+/m1/s1
InChIKey MKNOVQYZJKGTBD-RIYLTJNESA-N
Mol Weight 456.6 g/mol
Molecular Formula C31H36O3
Exact Mass 456.266445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3x418NJ5XW
Name 3-Isopropenyl-1,8,10b-trimethoxy-14-methyl-1,2,3,4,4a,4b,5,6,10b,14,14a-undecahydro-11-oxabenzo[3,4]cycloocta[1,2-a]naphthalene
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Formula C31H36O3
InChI InChI=1S/C31H36O3/c1-20(2)23-18-27-26-13-11-22-17-24(32-4)12-14-25(22)30(26)34-28(21-9-7-6-8-10-21)15-16-31(27,3)29(19-23)33-5/h6-10,12,14-15,17,23,27,29H,1,11,13,16,18-19H2,2-5H3/b28-15-/t23-,27+,29?,31+/m1/s1
InChIKey MKNOVQYZJKGTBD-RIYLTJNESA-N
Molecular Weight 456.626 g/mol
SMILES C12=C([C@]3([C@](C(OC)C[C@@](C3)(C(=C)C)[H])(C)C\C=C\(O1)c1ccccc1)[H])CCc1c2ccc(OC)c1
SPLASH splash10-0a4i-0121900000-314688d7ea0c32f95fa9
Source of Spectrum F-62-1734-29
Wiley ID 1632321