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3-[3'-Methyl-4'-(3-methylbenzyloxy)biphenyl-4-yloxy]propane-1,2-diol
SpectraBase Compound ID Lt2TSdwFyzs
InChI InChI=1S/C24H26O4/c1-17-4-3-5-19(12-17)15-28-24-11-8-21(13-18(24)2)20-6-9-23(10-7-20)27-16-22(26)14-25/h3-13,22,25-26H,14-16H2,1-2H3
InChIKey LKJLAYRUZJMOMW-UHFFFAOYSA-N
Mol Weight 378.47 g/mol
Molecular Formula C24H26O4
Exact Mass 378.183109 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LAD3aPIOZPk
Name 3-[3'-Methyl-4'-(3-methylbenzyloxy)biphenyl-4-yloxy]propane-1,2-diol
Comments Computed using HOSE algorithm
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Exact Mass 378.183109313 u
Formula C24H26O4
InChI InChI=1S/C24H26O4/c1-17-4-3-5-19(12-17)15-28-24-11-8-21(13-18(24)2)20-6-9-23(10-7-20)27-16-22(26)14-25/h3-13,22,25-26H,14-16H2,1-2H3
InChIKey LKJLAYRUZJMOMW-UHFFFAOYSA-N
Molecular Weight 378.468 g/mol
SMILES C=1(C=C(C)C(=CC1)OCC=1C=C(C)C=CC1)C1=CC=C(OCC(O)CO)C=C1