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D-Mannitol, 2,5-di-o-methyl-1,3:4,6-bis-o-(phenylmethylene)-, [1(R),4(R)]-
SpectraBase Compound ID 4XZSfRKbBic
InChI InChI=1S/C22H26O6/c1-23-17-13-25-21(15-9-5-3-6-10-15)27-19(17)20-18(24-2)14-26-22(28-20)16-11-7-4-8-12-16/h3-12,17-22H,13-14H2,1-2H3
InChIKey UDEBKKOWACLMEN-UHFFFAOYSA-N
Mol Weight 386.44 g/mol
Molecular Formula C22H26O6
Exact Mass 386.172939 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A8FRhn48Pee
Name D-Mannitol, 2,5-di-o-methyl-1,3:4,6-bis-o-(phenylmethylene)-, [1(R),4(R)]-
Comments Computed using HOSE algorithm
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Exact Mass 386.172938551 u
Formula C22H26O6
InChI InChI=1S/C22H26O6/c1-23-17-13-25-21(15-9-5-3-6-10-15)27-19(17)20-18(24-2)14-26-22(28-20)16-11-7-4-8-12-16/h3-12,17-22H,13-14H2,1-2H3
InChIKey UDEBKKOWACLMEN-UHFFFAOYSA-N
Molecular Weight 386.444 g/mol
SMILES C1(C2OC(C3=CC=CC=C3)OCC2OC)OC(C=2C=CC=CC2)OCC1OC