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(R)-allyl 6-methyl-2-oxo-4-phenyl-3,4-dihydro-2H-pyran-5-carboxylate
SpectraBase Compound ID 6JPpaOgTeFU
InChI InChI=1S/C16H16O4/c1-3-9-19-16(18)15-11(2)20-14(17)10-13(15)12-7-5-4-6-8-12/h3-8,13H,1,9-10H2,2H3/t13-/m1/s1
InChIKey UKMNNWAFJGARJP-CYBMUJFWSA-N
Mol Weight 272.3 g/mol
Molecular Formula C16H16O4
Exact Mass 272.104859 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GIGwuijZT5L
Name (R)-Allyl 6-methyl-2-oxo-4-phenyl-3,4-dihydro-2H-pyran-5-carboxylate
Comments Computed using HOSE algorithm
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Exact Mass 272.104858991 u
Formula C16H16O4
InChI InChI=1S/C16H16O4/c1-3-9-19-16(18)15-11(2)20-14(17)10-13(15)12-7-5-4-6-8-12/h3-8,13H,1,9-10H2,2H3/t13-/m1/s1
InChIKey UKMNNWAFJGARJP-CYBMUJFWSA-N
Molecular Weight 272.300 g/mol
SMILES C1C(=O)OC(=C([C@]1(C1=CC=CC=C1)[H])C(=O)OCC=C)C