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(1R,5R,6R)-5-Benzyl-6-carbethoxy-2-oxabicyclo[3.1.0]hexane
SpectraBase Compound ID DQvgEnZhnoU
InChI InChI=1S/C15H18O3/c1-2-17-14(16)12-13-15(12,8-9-18-13)10-11-6-4-3-5-7-11/h3-7,12-13H,2,8-10H2,1H3/t12-,13-,15+/m1/s1
InChIKey HFVGBTOGBGFSLC-NFAWXSAZSA-N
Mol Weight 246.31 g/mol
Molecular Formula C15H18O3
Exact Mass 246.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 15RBER0hnAY
Name (1R,5R,6R)-5-Benzyl-6-carbethoxy-2-oxabicyclo[3.1.0]hexane
Alternate Name(s) Ethyl (1R,5R,6R)-5-benzyl-2-oxabicyclo[3.1.0]hexane-6-carboxylate
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Formula C15H18O3
InChI InChI=1S/C15H18O3/c1-2-17-14(16)12-13-15(12,8-9-18-13)10-11-6-4-3-5-7-11/h3-7,12-13H,2,8-10H2,1H3/t12-,13-,15+/m1/s1
InChIKey HFVGBTOGBGFSLC-NFAWXSAZSA-N
Molecular Weight 246.306 g/mol
SMILES [C@@]12([C@@](C(=O)OCC)([C@]2(OCC1)[H])[H])Cc1ccccc1
SPLASH splash10-0a4l-4900000000-a2d6e3666783cfa44ac5
Source of Spectrum J-63-6014-36
Wiley ID 1249283