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(+)-(3R,4S,5R)-4-(Hexanoyloxy)-3-hydroxy-1,7-dioxaspiro[4.4]nonan-8-one (Secosyrin 1)
SpectraBase Compound ID 1mGcjSKLkS9
InChI InChI=1S/C13H20O6/c1-2-3-4-5-10(15)19-12-9(14)7-18-13(12)6-11(16)17-8-13/h9,12,14H,2-8H2,1H3/t9-,12+,13-/m1/s1
InChIKey BSPDBROUVLBHSZ-JIMOISOXSA-N
Mol Weight 272.3 g/mol
Molecular Formula C13H20O6
Exact Mass 272.125988 g/mol
Enantiomer InChIKey BSPDBROUVLBHSZ-BIMULSAOSA-N
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