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9-[(2S)-2-Hydroxy-3-methoxy-3-methylbutoxy]furo[3,2-G]chromen-7-one, tms
SpectraBase Compound ID AgyrYrZvKqe
InChI InChI=1S/C20H26O6Si/c1-20(2,22-3)15(26-27(4,5)6)12-24-19-17-14(9-10-23-17)11-13-7-8-16(21)25-18(13)19/h7-11,15H,12H2,1-6H3/t15-/m0/s1
InChIKey KEIPQSULWHINDZ-HNNXBMFYSA-N
Mol Weight 390.51 g/mol
Molecular Formula C20H26O6Si
Exact Mass 390.149865 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J9z841Zsyfo
Name 9-[(2S)-2-Hydroxy-3-methoxy-3-methylbutoxy]furo[3,2-G]chromen-7-one, tms
Comments Computed using HOSE algorithm
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Exact Mass 390.149865086 u
Formula C20H26O6Si
InChI InChI=1S/C20H26O6Si/c1-20(2,22-3)15(26-27(4,5)6)12-24-19-17-14(9-10-23-17)11-13-7-8-16(21)25-18(13)19/h7-11,15H,12H2,1-6H3/t15-/m0/s1
InChIKey KEIPQSULWHINDZ-HNNXBMFYSA-N
Molecular Weight 390.507 g/mol
SMILES C1(C=CC2=CC3=C(C(=C2O1)OC[C@@](C(C)(C)OC)(O[Si](C)(C)C)[H])OC=C3)=O