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ETHYL-(2R/S,6S,7S)-1-BENZYL-7-METHYL-4,6-DIPHENYL-2,3,6,7-TETRAHYDRO-1H-AZEPANE-2-CARBOXYLATE

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ETHYL-(2R/S,6S,7S)-1-BENZYL-7-METHYL-4,6-DIPHENYL-2,3,6,7-TETRAHYDRO-1H-AZEPANE-2-CARBOXYLATE
SpectraBase Compound ID KSjeKKrRh74
InChI InChI=1S/C29H31NO2/c1-3-32-29(31)28-20-26(24-15-9-5-10-16-24)19-27(25-17-11-6-12-18-25)22(2)30(28)21-23-13-7-4-8-14-23/h4-19,22,27-28H,3,20-21H2,1-2H3/t22-,27+,28?/m0/s1
InChIKey GJWGUOIWWAHRRG-YEOLDKCRSA-N
Mol Weight 425.57 g/mol
Molecular Formula C29H31NO2
Exact Mass 425.235479 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AnITO1HQLiu
Name ETHYL-(2R/S,6S,7S)-1-BENZYL-7-METHYL-4,6-DIPHENYL-2,3,6,7-TETRAHYDRO-1H-AZEPANE-2-CARBOXYLATE
Compound Number 38
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H31NO2
InChI InChI=1S/C29H31NO2/c1-3-32-29(31)28-20-26(24-15-9-5-10-16-24)19-27(25-17-11-6-12-18-25)22(2)30(28)21-23-13-7-4-8-14-23/h4-19,22,27-28H,3,20-21H2,1-2H3/t22-,27+,28?/m0/s1
InChIKey GJWGUOIWWAHRRG-YEOLDKCRSA-N
Literature Reference Author F.COUTY,F.DURRAT,G.EVANO,J.MARROT
Literature Reference Citation EUR.J.ORG.CHEM.,4214(2006)
Molecular Weight 425.571 g/mol
Sample ID 32838
Solvent Unknown