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3-[2,4-Bis(benzyloxy)-6-hydroxyphenyl]-1-[3,4,5-tris(benzyloxy)phenyl]-propane

View entire compound with spectra: 1 NMR, and 1 MS (GC)

3-[2,4-Bis(benzyloxy)-6-hydroxyphenyl]-1-[3,4,5-tris(benzyloxy)phenyl]-propane
SpectraBase Compound ID KwiEmzGp3c5
InChI InChI=1S/C50H46O6/c51-46-31-44(52-33-38-17-6-1-7-18-38)32-47(53-34-39-19-8-2-9-20-39)45(46)28-16-27-43-29-48(54-35-40-21-10-3-11-22-40)50(56-37-42-25-14-5-15-26-42)49(30-43)55-36-41-23-12-4-13-24-41/h1-15,17-26,29-32,51H,16,27-28,33-37H2
InChIKey FLSYNLNAQMTNII-UHFFFAOYSA-N
Mol Weight 742.9 g/mol
Molecular Formula C50H46O6
Exact Mass 742.329439 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FHqhQH8fhRa
Name 3-[2,4-bis(Benzyloxy)-6-hydroxyphenyl]-1-[3,4,5-tris(benzyloxy)phenyl]-propane
Comments Computed using HOSE algorithm
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Exact Mass 742.329439195 u
Formula C50H46O6
InChI InChI=1S/C50H46O6/c51-46-31-44(52-33-38-17-6-1-7-18-38)32-47(53-34-39-19-8-2-9-20-39)45(46)28-16-27-43-29-48(54-35-40-21-10-3-11-22-40)50(56-37-42-25-14-5-15-26-42)49(30-43)55-36-41-23-12-4-13-24-41/h1-15,17-26,29-32,51H,16,27-28,33-37H2
InChIKey FLSYNLNAQMTNII-UHFFFAOYSA-N
Molecular Weight 742.912 g/mol
SMILES C1(=C(OCC2=CC=CC=C2)C=C(C=C1OCC=1C=CC=CC1)CCCC1=C(C=C(C=C1O)OCC1=CC=CC=C1)OCC1=CC=CC=C1)OCC1=CC=CC=C1