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1,2-Ethanediol, 1-[3,4-bis(phenylmethoxy)phenyl]-, (R)-
SpectraBase Compound ID BytUHc8eD9M
InChI InChI=1S/C22H22O4/c23-14-20(24)19-11-12-21(25-15-17-7-3-1-4-8-17)22(13-19)26-16-18-9-5-2-6-10-18/h1-13,20,23-24H,14-16H2/t20-/m0/s1
InChIKey TUPSTLDQFNUXKF-FQEVSTJZSA-N
Mol Weight 350.41 g/mol
Molecular Formula C22H22O4
Exact Mass 350.151809 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FNwjlIBXAkz
Name 1,2-Ethanediol, 1-[3,4-bis(phenylmethoxy)phenyl]-, (R)-
Comments Computed using HOSE algorithm
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Exact Mass 350.151809184 u
Formula C22H22O4
InChI InChI=1S/C22H22O4/c23-14-20(24)19-11-12-21(25-15-17-7-3-1-4-8-17)22(13-19)26-16-18-9-5-2-6-10-18/h1-13,20,23-24H,14-16H2/t20-/m0/s1
InChIKey TUPSTLDQFNUXKF-FQEVSTJZSA-N
Molecular Weight 350.414 g/mol
SMILES C1(=CC([C@@](O)(CO)[H])=CC=C1OCC1=CC=CC=C1)OCC=1C=CC=CC1