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ACETYLGLUTINOL
SpectraBase Compound ID 9JqzHl1Btg5
InChI InChI=1S/C32H52O2/c1-21(33)34-26-13-11-23-22(28(26,4)5)10-12-24-30(23,7)17-19-32(9)25-20-27(2,3)14-15-29(25,6)16-18-31(24,32)8/h10,23-26H,11-20H2,1-9H3/t23?,24?,25?,26-,29+,30-,31+,32-/m0/s1
InChIKey CQQNBMVDVWGBMD-BOXPYESXSA-N
Mol Weight 468.8 g/mol
Molecular Formula C32H52O2
Exact Mass 468.396731 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 600sth18MJ9
Name (3S,6bR,8aR,12bS,14aR)-4,4,6b,8a,11,11,12b,14a-octamethyl-1,2,3,4,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14,14a,14b-icosahydropicen-3-yl acetate
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Formula C32H52O2
InChI InChI=1S/C32H52O2/c1-21(33)34-26-13-11-23-22(28(26,4)5)10-12-24-30(23,7)17-19-32(9)25-20-27(2,3)14-15-29(25,6)16-18-31(24,32)8/h10,23-26H,11-20H2,1-9H3/t23?,24?,25?,26-,29+,30-,31+,32-/m0/s1
InChIKey CQQNBMVDVWGBMD-BOXPYESXSA-N
Molecular Weight 468.766 g/mol
SMILES C1[C@@](C(C=2C(C1)[C@]1(C(CC2)[C@@]2([C@@](CC1)(C1[C@@](CC2)(CCC(C1)(C)C)C)C)C)C)(C)C)(OC(C)=O)[H]
SPLASH splash10-0aor-4930000000-944944f52f4f64cd843b
Source of Spectrum Marlene Lavrieux, et al. Organic Geochemistry, V. 42, 2011, P.1315-1323
Wiley ID 1817485