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1-[(3aR,5S,6R,6aR)-2,2-dimethyl-6-oxidanyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-3-oxidanyl-3-phenyl-propan-1-one

View entire compound with spectra: 1 MS (GC)

1-[(3aR,5S,6R,6aR)-2,2-dimethyl-6-oxidanyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-3-oxidanyl-3-phenyl-propan-1-one
SpectraBase Compound ID 1FNevGEpdiS
InChI InChI=1S/C16H20O6/c1-16(2)21-14-12(19)13(20-15(14)22-16)11(18)8-10(17)9-6-4-3-5-7-9/h3-7,10,12-15,17,19H,8H2,1-2H3/t10?,12-,13+,14+,15+/m0/s1
InChIKey KDRRQNVRRAYMOY-GIPIHTCXSA-N
Mol Weight 308.33 g/mol
Molecular Formula C16H20O6
Exact Mass 308.125988 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I0XUWfqdJiS
Name 1-[(3aR,5S,6R,6aR)-2,2-dimethyl-6-oxidanyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-3-oxidanyl-3-phenyl-propan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O6
InChI InChI=1S/C16H20O6/c1-16(2)21-14-12(19)13(20-15(14)22-16)11(18)8-10(17)9-6-4-3-5-7-9/h3-7,10,12-15,17,19H,8H2,1-2H3/t10?,12-,13+,14+,15+/m0/s1
InChIKey KDRRQNVRRAYMOY-GIPIHTCXSA-N
Molecular Weight 308.330 g/mol
SMILES O[C@]1([C@@](C(CC(c2ccccc2)O)=O)(O[C@]2([C@@]1(OC(O2)(C)C)[H])[H])[H])[H]
SPLASH splash10-0006-9331000000-cb7bbcd3a3be25efbd3a
Source of Spectrum Y-40-343-5
Synonyms 1-[(3aR,5S,6R,6aR)-6-hydroxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-3-hydroxy-3-phenyl-1-propanone 1-[(3aR,5S,6R,6aR)-6-hydroxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-3-hydroxy-3-phenyl-propan-1-one
Wiley ID 1528839