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(1S,5S,8S)-1,5-dimethyl-8-oxidanyl-8-[(E)-3-oxidanylbut-1-enyl]-6-oxabicyclo[3.2.1]octan-3-one
SpectraBase Compound ID 1gCZsvgqvfy
InChI InChI=1S/C13H20O4/c1-9(14)4-5-13(16)11(2)6-10(15)7-12(13,3)17-8-11/h4-5,9,14,16H,6-8H2,1-3H3/b5-4+/t9?,11-,12-,13-/m0/s1
InChIKey KENVUEOHDFOVNA-HQZIRTJDSA-N
Mol Weight 240.3 g/mol
Molecular Formula C13H20O4
Exact Mass 240.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gp2jy5AFDGh
Name (1S,5S,8S)-1,5-dimethyl-8-oxidanyl-8-[(E)-3-oxidanylbut-1-enyl]-6-oxabicyclo[3.2.1]octan-3-one
Alternate Name(s) (1S,5S,8S)-8-hydroxy-8-[(E)-3-hydroxybut-1-enyl]-1,5-dimethyl-6-oxabicyclo[3.2.1]octan-3-one Drummondol
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Formula C13H20O4
InChI InChI=1S/C13H20O4/c1-9(14)4-5-13(16)11(2)6-10(15)7-12(13,3)17-8-11/h4-5,9,14,16H,6-8H2,1-3H3/b5-4+/t9?,11-,12-,13-/m0/s1
InChIKey KENVUEOHDFOVNA-HQZIRTJDSA-N
Molecular Weight 240.299 g/mol
SMILES OC(\C=C\[C@@]1([C@@]2(CO[C@]1(CC(=O)C2)C)C)O)C
SPLASH splash10-052f-9100000000-7de2b4b9e3e1adf88da1
Source of Spectrum X2-44-90-2
Wiley ID 1600854