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(2S,3R)-[(1R,2S,5R)-2-ISOPROPYL-5-METHYLCYCLOHEXYL]-2-(4-BROMOPHENYL)-3-(TERT.-BUTOXYCARBONYLAMINO)-TETRAHYDROFURAN-3-CARBOXYLATE
SpectraBase Compound ID 7f2S9ZOuDAE
InChI InChI=1S/C26H38BrNO5/c1-16(2)20-12-7-17(3)15-21(20)32-23(29)26(28-24(30)33-25(4,5)6)13-14-31-22(26)18-8-10-19(27)11-9-18/h8-11,16-17,20-22H,7,12-15H2,1-6H3,(H,28,30)/t17-,20+,21-,22-,26-/m1/s1
InChIKey OJJTWGDZDRNKHR-IYJIWLEUSA-N
Mol Weight 524.5 g/mol
Molecular Formula C26H38BrNO5
Exact Mass 523.193336 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1f1EPqpazgx
Name (2S,3R)-[(1R,2S,5R)-2-ISOPROPYL-5-METHYLCYCLOHEXYL]-2-(4-BROMOPHENYL)-3-(TERT.-BUTOXYCARBONYLAMINO)-TETRAHYDROFURAN-3-CARBOXYLATE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H38BrNO5
InChI InChI=1S/C26H38BrNO5/c1-16(2)20-12-7-17(3)15-21(20)32-23(29)26(28-24(30)33-25(4,5)6)13-14-31-22(26)18-8-10-19(27)11-9-18/h8-11,16-17,20-22H,7,12-15H2,1-6H3,(H,28,30)/t17-,20+,21-,22-,26-/m1/s1
InChIKey OJJTWGDZDRNKHR-IYJIWLEUSA-N
Literature Reference Author A.GRAUER,B.KOENIG
Literature Reference Citation MOLBANK,M594(2009)
Molecular Weight 524.495 g/mol
Solvent CDCl3
Source File Reference UWLU83062