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[(2S,4R,4aR,7R,8aR)-4,7-dimethyl-2-propyl-2,3,4a,5,6,7,8,8a-octahydrochromen-4-yl] acetate
SpectraBase Compound ID F32IRJ2d9Rq
InChI InChI=1S/C16H28O3/c1-5-6-13-10-16(4,19-12(3)17)14-8-7-11(2)9-15(14)18-13/h11,13-15H,5-10H2,1-4H3/t11-,13+,14-,15-,16-/m1/s1
InChIKey DTYVZWNWWJRXNO-DPZJBDQQSA-N
Mol Weight 268.4 g/mol
Molecular Formula C16H28O3
Exact Mass 268.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FCK2BvtB1Df
Name [(2S,4R,4aR,7R,8aR)-4,7-dimethyl-2-propyl-2,3,4a,5,6,7,8,8a-octahydrochromen-4-yl] acetate
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Formula C16H28O3
InChI InChI=1S/C16H28O3/c1-5-6-13-10-16(4,19-12(3)17)14-8-7-11(2)9-15(14)18-13/h11,13-15H,5-10H2,1-4H3/t11-,13+,14-,15-,16-/m1/s1
InChIKey DTYVZWNWWJRXNO-DPZJBDQQSA-N
Ionization Type EI
Molecular Weight 268.397 g/mol
SMILES C1[C@@]([C@]2([C@](O[C@]1(CCC)[H])(C[C@@](CC2)(C)[H])[H])[H])(C)OC(C)=O
SPLASH splash10-066u-4910000000-9c99b6bae703988f7651
Source of Spectrum EP3464258A1
Wiley ID 1872786