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3.beta.-Acetoxy-Spongia-13(16),14-diene
SpectraBase Compound ID A6m3QIbXMyW
InChI InChI=1S/C22H32O3/c1-14(23)25-19-9-11-22(5)17(20(19,2)3)8-10-21(4)16-13-24-12-15(16)6-7-18(21)22/h12-13,17-19H,6-11H2,1-5H3/t17-,18-,19-,21-,22-/m0/s1
InChIKey DUYNKHFSOPGXQD-PAPPXSOASA-N
Mol Weight 344.5 g/mol
Molecular Formula C22H32O3
Exact Mass 344.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8CwF3Y1qT41
Name 3.beta.-Acetoxy-Spongia-13(16),14-diene
Alternate Name(s) Acetic acid [(3bR,5aR,7S,9aR,9bR)-3b,6,6,9a-tetramethyl-5,5a,7,8,9,9b,10,11-octahydro-4H-naphtho[2,1-e]isobenzofuran-7-yl] ester [(3bR,5aR,7S,9aR,9bR)-3b,6,6,9a-tetramethyl-5,5a,7,8,9,9b,10,11-octahydro-4H-naphtho[2,1-e][2]benzofuran-7-yl] acetate [(3bR,5aR,7S,9aR,9bR)-3b,6,6,9a-tetramethyl-5,5a,7,8,9,9b,10,11-octahydro-4H-naphtho[2,1-e]isobenzofuran-7-yl] acetate [(3bR,5aR,7S,9aR,9bR)-3b,6,6,9a-tetramethyl-5,5a,7,8,9,9b,10,11-octahydro-4H-naphtho[2,1-e][2]benzofuran-7-yl] ethanoate
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Formula C22H32O3
InChI InChI=1S/C22H32O3/c1-14(23)25-19-9-11-22(5)17(20(19,2)3)8-10-21(4)16-13-24-12-15(16)6-7-18(21)22/h12-13,17-19H,6-11H2,1-5H3/t17-,18-,19-,21-,22-/m0/s1
InChIKey DUYNKHFSOPGXQD-PAPPXSOASA-N
Molecular Weight 344.495 g/mol
SMILES [C@@]12(c3c(coc3)CC[C@@]1([C@@]1([C@@](C([C@@](OC(=O)C)(CC1)[H])(C)C)([H])CC2)C)[H])C
SPLASH splash10-014l-0079000000-38f9d1b7aade7e5b4b39
Source of Spectrum G4-70-1112-4
Wiley ID 1694746