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(2S,5S)-6-Oxo-5-phenethyl-tetrahydro-pyran-2-carboxylic acid ethyl ester
SpectraBase Compound ID BXQYOoXkLQi
InChI InChI=1S/C16H20O4/c1-2-19-16(18)14-11-10-13(15(17)20-14)9-8-12-6-4-3-5-7-12/h3-7,13-14H,2,8-11H2,1H3/t13-,14-/m0/s1
InChIKey MWIQQRQPDHLPPX-KBPBESRZSA-N
Mol Weight 276.33 g/mol
Molecular Formula C16H20O4
Exact Mass 276.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 61xgJd0dUto
Name (2S,5S)-6-Oxo-5-phenethyl-tetrahydro-pyran-2-carboxylic acid ethyl ester
Alternate Name(s) 6-Eyhoxycarbonyl-3-(2-phenylethyl)tetrahydropyran-2-one
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Formula C16H20O4
InChI InChI=1S/C16H20O4/c1-2-19-16(18)14-11-10-13(15(17)20-14)9-8-12-6-4-3-5-7-12/h3-7,13-14H,2,8-11H2,1H3/t13-,14-/m0/s1
InChIKey MWIQQRQPDHLPPX-KBPBESRZSA-N
Molecular Weight 276.332 g/mol
SMILES C1(O[C@@](CC[C@@]1(CCc1ccccc1)[H])(C(=O)OCC)[H])=O
SPLASH splash10-0ki6-3910000000-1526066f4ed176971b29
Source of Spectrum F4-41-1333-38
Wiley ID 1672035