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(+/-)-[(1aR,2S,5R,5aS)-5-Methylperhydrooxireno[2,3-d][1,2]dioxin-2-yl]methyl benzyl ether
SpectraBase Compound ID 1pgZ66OgRYM
InChI InChI=1S/C13H16O4/c1-9-12-13(15-12)11(17-16-9)8-14-7-10-5-3-2-4-6-10/h2-6,9,11-13H,7-8H2,1H3/t9-,11+,12-,13+/m1/s1
InChIKey SXWNQGFEAPKNCG-MGAJPHDKSA-N
Mol Weight 236.27 g/mol
Molecular Formula C13H16O4
Exact Mass 236.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID PfDWAhnoO
Name (+/-)-[(1aR,2S,5R,5aS)-5-Methylperhydrooxireno[2,3-d][1,2]dioxin-2-yl]methyl benzyl ether
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Formula C13H16O4
InChI InChI=1S/C13H16O4/c1-9-12-13(15-12)11(17-16-9)8-14-7-10-5-3-2-4-6-10/h2-6,9,11-13H,7-8H2,1H3/t9-,11+,12-,13+/m1/s1
InChIKey SXWNQGFEAPKNCG-MGAJPHDKSA-N
Molecular Weight 236.267 g/mol
SMILES [C@@]12(O[C@@]2([C@@](C)(OO[C@]1(COCc1ccccc1)[H])[H])[H])[H]
SPLASH splash10-054o-9400000000-141a789f84164134c2a0
Source of Spectrum J-15-41-2p
Synonyms (+/-)-[(1aS,2R,5S,5aR)-5-Methylperhydrooxireno[2,3-d][1,2]dioxin-2-yl]methyl benzyl ether (1R,2S,5R,6S)-2-((benzyloxy)methyl)-5-methyl-3,4,7-trioxabicyclo[4.1.0]heptane (1S,2R,5S,6R)-5-(benzyloxymethyl)-2-methyl-3,4,7-trioxabicyclo[4.1.0]heptane (1S,2R,5S,6R)-2-methyl-5-(phenylmethoxymethyl)-3,4,7-trioxabicyclo[4.1.0]heptane
Wiley ID 1733867