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(1S,2R,5R,6S)-5-AMINO-2,6-DIBENZYLOXY-3-BENZYLOXYMETHYL-CYCLOHEX-3-EN-1-OL
SpectraBase Compound ID K6Kq3ppe4Ve
InChI InChI=1S/C28H31NO4/c29-25-16-24(20-31-17-21-10-4-1-5-11-21)27(32-18-22-12-6-2-7-13-22)26(30)28(25)33-19-23-14-8-3-9-15-23/h1-16,25-28,30H,17-20,29H2/t25-,26+,27-,28+/m1/s1
InChIKey BLPDYGVYLNWKFN-GCFVYEKYSA-N
Mol Weight 445.56 g/mol
Molecular Formula C28H31NO4
Exact Mass 445.225308 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1OPRhPuEpvQ
Name (1S,2R,5R,6S)-5-AMINO-2,6-DIBENZYLOXY-3-BENZYLOXYMETHYL-CYCLOHEX-3-EN-1-OL
Compound Number 22
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H31NO4
InChI InChI=1S/C28H31NO4/c29-25-16-24(20-31-17-21-10-4-1-5-11-21)27(32-18-22-12-6-2-7-13-22)26(30)28(25)33-19-23-14-8-3-9-15-23/h1-16,25-28,30H,17-20,29H2/t25-,26+,27-,28+/m1/s1
InChIKey BLPDYGVYLNWKFN-GCFVYEKYSA-N
Literature Reference Author J.K.FAIRWEATHER,M.J.MCDONOUGH,R.V.STICK,D.M.G.TILBROOK
Literature Reference Citation AUSTR.J.CHEM.,57,197(2004)
Literature Reference DOI 10.1071/CH03203
Molecular Weight 445.558 g/mol
Solvent Unknown
Source File Reference UWVN7472