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(3R,5R,6S)-5-[BENZYL-(HYDROXY)-AMINO]-3-BROMO-6-(HYDROXYMETHYL)-3-(3-HYDROXYPROPYL)-2,2-DIMETHYLDIHYDRO-2H-PYRAN-4(3H)-ONE

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(3R,5R,6S)-5-[BENZYL-(HYDROXY)-AMINO]-3-BROMO-6-(HYDROXYMETHYL)-3-(3-HYDROXYPROPYL)-2,2-DIMETHYLDIHYDRO-2H-PYRAN-4(3H)-ONE
SpectraBase Compound ID 40OQnFguT9u
InChI InChI=1S/C18H26BrNO5/c1-17(2)18(19,9-6-10-21)16(23)15(14(12-22)25-17)20(24)11-13-7-4-3-5-8-13/h3-5,7-8,14-15,21-22,24H,6,9-12H2,1-2H3/t14-,15-,18+/m1/s1
InChIKey LKVDJLHTRIHJLD-RKVPGOIHSA-N
Mol Weight 416.31 g/mol
Molecular Formula C18H26BrNO5
Exact Mass 415.099436 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J1epqLOYqb2
Name (3R,5R,6S)-5-[BENZYL-(HYDROXY)-AMINO]-3-BROMO-6-(HYDROXYMETHYL)-3-(3-HYDROXYPROPYL)-2,2-DIMETHYLDIHYDRO-2H-PYRAN-4(3H)-ONE
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H25BrNO5
InChI InChI=1S/C18H26BrNO5/c1-17(2)18(19,9-6-10-21)16(23)15(14(12-22)25-17)20(24)11-13-7-4-3-5-8-13/h3-5,7-8,14-15,21-22,24H,6,9-12H2,1-2H3/t14-,15-,18+/m1/s1
InChIKey LKVDJLHTRIHJLD-RKVPGOIHSA-N
Literature Reference Author F.PFRENGLE,H.U.REISSIG
Literature Reference Citation BEIL.J.ORG.CHEM.,6,75,1(2010)
Molecular Weight 415.304 g/mol
Solvent CDCl3
Source File Reference UWBT10083