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5-Isoxazolidinol, 2,3-diphenyl-, acetate (ester), cis-
SpectraBase Compound ID 8pbLXfBgGE
InChI InChI=1S/C17H17NO3/c1-13(19)20-17-12-16(14-8-4-2-5-9-14)18(21-17)15-10-6-3-7-11-15/h2-11,16-17H,12H2,1H3/t16-,17+/m0/s1
InChIKey NFCRCWGPKGNBJN-DLBZAZTESA-N
Mol Weight 283.33 g/mol
Molecular Formula C17H17NO3
Exact Mass 283.120843 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9ojGiJ1Mfe8
Name 5-Isoxazolidinol, 2,3-diphenyl-, acetate (ester), cis-
Comments Computed using HOSE algorithm
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Exact Mass 283.120843408 u
Formula C17H17NO3
InChI InChI=1S/C17H17NO3/c1-13(19)20-17-12-16(14-8-4-2-5-9-14)18(21-17)15-10-6-3-7-11-15/h2-11,16-17H,12H2,1H3/t16-,17+/m0/s1
InChIKey NFCRCWGPKGNBJN-DLBZAZTESA-N
SMILES [C@]1(N(O[C@](C1)(OC(=O)C)[H])C=1C=CC=CC1)(C1=CC=CC=C1)[H]