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6H-Benzofuro[3,2-c][1]benzopyran-6a,9(11aH)-diol, 3-methoxy-, cis-
SpectraBase Compound ID 1yH3qMOXkKu
InChI InChI=1S/C16H14O5/c1-19-10-3-4-11-13(7-10)20-8-16(18)12-5-2-9(17)6-14(12)21-15(11)16/h2-7,15,17-18H,8H2,1H3/t15-,16+/m1/s1
InChIKey MENGTHFLVHDIFW-CVEARBPZSA-N
Mol Weight 286.28 g/mol
Molecular Formula C16H14O5
Exact Mass 286.084124 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID kPPNBg6bRa
Name 6H-Benzofuro[3,2-C][1]benzopyran-6A,9(11AH)-diol, 3-methoxy-, cis-
Comments Computed using HOSE algorithm
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Exact Mass 286.084123546 u
Formula C16H14O5
InChI InChI=1S/C16H14O5/c1-19-10-3-4-11-13(7-10)20-8-16(18)12-5-2-9(17)6-14(12)21-15(11)16/h2-7,15,17-18H,8H2,1H3/t15-,16+/m1/s1
InChIKey MENGTHFLVHDIFW-CVEARBPZSA-N
SMILES [C@]12([C@](OC=3C2=CC=C(O)C3)(C2=CC=C(C=C2OC1)OC)[H])O