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(3aR,8aR,9aR)-3-[[(2-methoxyphenyl)methylamino]methyl]-8a-methyl-5-methylene-3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f]benzofuran-2-one
SpectraBase Compound ID I4aJIiYdJMH
InChI InChI=1S/C23H31NO3/c1-15-7-6-10-23(2)12-21-17(11-19(15)23)18(22(25)27-21)14-24-13-16-8-4-5-9-20(16)26-3/h4-5,8-9,17-19,21,24H,1,6-7,10-14H2,2-3H3/t17-,18?,19?,21-,23-/m1/s1
InChIKey REYKQEWDDZDTTM-MRMDNLSOSA-N
Mol Weight 369.51 g/mol
Molecular Formula C23H31NO3
Exact Mass 369.230394 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kpz6JrcoNEs
Name (3aR,8aR,9aR)-3-[[(2-methoxyphenyl)methylamino]methyl]-8a-methyl-5-methylene-3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f]benzofuran-2-one
Alternate Name(s) (3aR,8aR,9aR)-3-[[(2-methoxyphenyl)methylamino]methyl]-8a-methyl-5-methylidene-3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f][1]benzofuran-2-one (3aR,8aR,9aR)-8a-methyl-5-methylene-3-[(o-anisylamino)methyl]-3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f]benzofuran-2-one
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Formula C23H31NO3
InChI InChI=1S/C23H31NO3/c1-15-7-6-10-23(2)12-21-17(11-19(15)23)18(22(25)27-21)14-24-13-16-8-4-5-9-20(16)26-3/h4-5,8-9,17-19,21,24H,1,6-7,10-14H2,2-3H3/t17-,18?,19?,21-,23-/m1/s1
InChIKey REYKQEWDDZDTTM-MRMDNLSOSA-N
Molecular Weight 369.505 g/mol
SMILES N(CC1C(O[C@@]2(C[C@]3(CCCC(C3C[C@]12[H])=C)C)[H])=O)Cc1c(OC)cccc1
SPLASH splash10-000i-3900000000-710bdd548364c37d9ca7
Wiley ID 1453128