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D-Erythro-2-pentulose, 1-deoxy-3,5-o-(phenylmethylene)-, acetate
SpectraBase Compound ID G1YNlMSnzcO
InChI InChI=1S/C14H16O5/c1-9(15)13-12(18-10(2)16)8-17-14(19-13)11-6-4-3-5-7-11/h3-7,12-14H,8H2,1-2H3/t12-,13?,14?/m0/s1
InChIKey VXPLOVMSZRXELR-HSBZDZAISA-N
Mol Weight 264.28 g/mol
Molecular Formula C14H16O5
Exact Mass 264.099774 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1Y09T2XzPaa
Name D-Erythro-2-pentulose, 1-deoxy-3,5-o-(phenylmethylene)-, acetate
Comments Computed using HOSE algorithm
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Exact Mass 264.099773610 u
Formula C14H16O5
InChI InChI=1S/C14H16O5/c1-9(15)13-12(18-10(2)16)8-17-14(19-13)11-6-4-3-5-7-11/h3-7,12-14H,8H2,1-2H3/t12-,13?,14?/m0/s1
InChIKey VXPLOVMSZRXELR-HSBZDZAISA-N
Molecular Weight 264.277 g/mol
SMILES C1(OC(OC[C@@]1(OC(=O)C)[H])C1=CC=CC=C1)C(=O)C