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7-Oxabicyclo[2.2.1]heptan-2-one, 5-hydroxy-6-(phenylmethoxy)-, (5-exo,6-endo)-(.+-.)-
SpectraBase Compound ID 6BL1ttjnRAP
InChI InChI=1S/C13H14O4/c14-9-6-10-11(15)13(12(9)17-10)16-7-8-4-2-1-3-5-8/h1-5,10-13,15H,6-7H2/t10-,11+,12+,13-/m1/s1
InChIKey HKOUZJBKTVQUAI-MROQNXINSA-N
Mol Weight 234.25 g/mol
Molecular Formula C13H14O4
Exact Mass 234.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9R6svP5Gx92
Name 7-Oxabicyclo[2.2.1]heptan-2-one, 5-hydroxy-6-(phenylmethoxy)-, (5-exo,6-endo)-(.+-.)-
CAS Registry Number 115140-20-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O4
InChI InChI=1S/C13H14O4/c14-9-6-10-11(15)13(12(9)17-10)16-7-8-4-2-1-3-5-8/h1-5,10-13,15H,6-7H2/t10-,11+,12+,13-/m1/s1
InChIKey HKOUZJBKTVQUAI-MROQNXINSA-N
Molecular Weight 234.251 g/mol
SMILES O[C@@]1([C@]([C@]2(O[C@@]1(CC2=O)[H])[H])(OCc1ccccc1)[H])[H]
SPLASH splash10-0006-9100000000-6aefa73a39ce67c2dc43
Source of Spectrum H-70-1717-28
Synonyms (1RS,4RS,5RS,6SR)-6-endo-(benzyloxy)-5-exo-hydroxy-7-oxabicyclo[2.2.1]heptan-2-one 6-(benzyloxy)-5-hydroxy-7-oxabicyclo[2.2.1]heptan-2-one
Wiley ID 1235901