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alpha-{[3,4-bis(Benzyloxy)]phenyl}-alpha-[(dibenzylamino)methyl]phenethyl alcohol
SpectraBase Compound ID 5JvGJF8Powg
InChI InChI=1S/C43H41NO3/c45-43(29-35-16-6-1-7-17-35,34-44(30-36-18-8-2-9-19-36)31-37-20-10-3-11-21-37)40-26-27-41(46-32-38-22-12-4-13-23-38)42(28-40)47-33-39-24-14-5-15-25-39/h1-28,45H,29-34H2
InChIKey DBDSNMOYTOUZGX-UHFFFAOYSA-N
Mol Weight 619.8 g/mol
Molecular Formula C43H41NO3
Exact Mass 619.308644 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J4iFoDYifYY
Name alpha-{[3,4-bis(Benzyloxy)]phenyl}-alpha-[(dibenzylamino)methyl]phenethyl alcohol
Comments Computed using HOSE algorithm
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Exact Mass 619.308644181 u
Formula C43H41NO3
InChI InChI=1S/C43H41NO3/c45-43(29-35-16-6-1-7-17-35,34-44(30-36-18-8-2-9-19-36)31-37-20-10-3-11-21-37)40-26-27-41(46-32-38-22-12-4-13-23-38)42(28-40)47-33-39-24-14-5-15-25-39/h1-28,45H,29-34H2
InChIKey DBDSNMOYTOUZGX-UHFFFAOYSA-N
Molecular Weight 619.805 g/mol
SMILES OC(C=1C=C(C(=CC1)OCC=1C=CC=CC1)OCC=1C=CC=CC1)(CN(CC=1C=CC=CC1)CC=1C=CC=CC1)CC=1C=CC=CC1