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4,4,6a,8a,11,11,14b-Heptamethyl-7,13-dioxo-1,2,3,4,4a,5,6,6a,7,8,8a,9,10,11,12,12a,13,14,14a,14b-icosahydro-3-picenyl acetate
SpectraBase Compound ID 1yy7v64EBB5
InChI InChI=1S/C31H46O4/c1-18(32)35-24-10-12-30(7)22(28(24,4)5)9-11-31(8)23(30)15-20(33)25-19-16-27(2,3)13-14-29(19,6)17-21(34)26(25)31/h19,22-24H,9-17H2,1-8H3
InChIKey BNVLVUSMSJXBMD-UHFFFAOYSA-N
Mol Weight 482.7 g/mol
Molecular Formula C31H46O4
Exact Mass 482.33961 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BAQVI0QwSXV
Name 4,4,6a,8a,11,11,14b-Heptamethyl-7,13-dioxo-1,2,3,4,4a,5,6,6a,7,8,8a,9,10,11,12,12a,13,14,14a,14b-icosahydro-3-picenyl acetate
Alternate Name(s) (4,4,6a,8a,11,11,14b-heptamethyl-7,13-dioxo-2,3,4a,5,6,8,9,10,12,12a,14,14a-dodecahydro-1H-picen-3-yl) acetate Acetic acid, 4,4,6a,8a,11,11,14b-heptamethyl-7,13-dioxo-1,2,3,4,4a,5,6,6a,7,8,8a,9,10,11,12,12a,13,14,14a,14b-eicosahydropicen-3-yl ester Acetic acid (4,4,6a,8a,11,11,14b-heptamethyl-7,13-dioxo-2,3,4a,5,6,8,9,10,12,12a,14,14a-dodecahydro-1H-picen-3-yl) ester Acetic acid (7,13-diketo-4,4,6a,8a,11,11,14b-heptamethyl-2,3,4a,5,6,8,9,10,12,12a,14,14a-dodecahydro-1H-picen-3-yl) ester [4,4,6a,8a,11,11,14b-heptamethyl-7,13-bis(oxidanylidene)-2,3,4a,5,6,8,9,10,12,12a,14,14a-dodecahydro-1H-picen-3-yl] ethanoate
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Formula C31H46O4
InChI InChI=1S/C31H46O4/c1-18(32)35-24-10-12-30(7)22(28(24,4)5)9-11-31(8)23(30)15-20(33)25-19-16-27(2,3)13-14-29(19,6)17-21(34)26(25)31/h19,22-24H,9-17H2,1-8H3
InChIKey BNVLVUSMSJXBMD-UHFFFAOYSA-N
Molecular Weight 482.705 g/mol
SMILES C12=C(C3CC(C)(C)CCC3(CC2=O)C)C(=O)CC2C1(CCC1C(C(OC(=O)C)CCC21C)(C)C)C
SPLASH splash10-001l-6952500000-3ab1aac29932eac34da8
Wiley ID 1486701