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5-Acetoxy-6-acetoxymethyl-2-propa-1,2-dienyl-2H-dihydropyran isomer
SpectraBase Compound ID 85i8iqUmOWh
InChI InChI=1S/C13H16O5/c1-4-5-11-6-7-12(17-10(3)15)13(18-11)8-16-9(2)14/h5-7,11-13H,1,8H2,2-3H3/t11-,12-,13-/m1/s1
InChIKey APNNABCZRNAQAR-JHJVBQTASA-N
Mol Weight 252.27 g/mol
Molecular Formula C13H16O5
Exact Mass 252.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Vq6HA70c8Q
Name 5-Acetoxy-6-acetoxymethyl-2-propa-1,2-dienyl-2H-dihydropyran isomer
Alternate Name(s) Acetic acid [(2R,3R,6S)-3-acetyloxy-6-propa-1,2-dienyl-3,6-dihydro-2H-pyran-2-yl]methyl ester [(2R,3R,6S)-3-acetyloxy-6-propa-1,2-dienyl-3,6-dihydro-2H-pyran-2-yl]methyl acetate [(2R,3R,6S)-3-acetoxy-6-propa-1,2-dienyl-3,6-dihydro-2H-pyran-2-yl]methyl acetate [(2R,3R,6S)-3-acetyloxy-6-propa-1,2-dienyl-3,6-dihydro-2H-pyran-2-yl]methyl ethanoate
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Formula C13H16O5
InChI InChI=1S/C13H16O5/c1-4-5-11-6-7-12(17-10(3)15)13(18-11)8-16-9(2)14/h5-7,11-13H,1,8H2,2-3H3/t11-,12-,13-/m1/s1
InChIKey APNNABCZRNAQAR-JHJVBQTASA-N
Molecular Weight 252.266 g/mol
SMILES [C@]1(O[C@@](C=C=C)([H])C=C[C@]1(OC(=O)C)[H])(COC(=O)C)[H]
SPLASH splash10-03di-0920000000-36ff9781ce3ce7ef2d70
Source of Spectrum F-57-10244-4
Wiley ID 1626819