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((4R,5S)-2-[(RS)-4,8-DIMETHYLNONYL]-2-METHYL-1,3-DIOXOLAN-4,5-DIYL)-DIMETHYLOCTANOATE
SpectraBase Compound ID BNAXNYMq39y
InChI InChI=1S/C33H62O6/c1-7-9-11-13-15-22-31(34)36-25-29-30(26-37-32(35)23-16-14-12-10-8-2)39-33(6,38-29)24-18-21-28(5)20-17-19-27(3)4/h27-30H,7-26H2,1-6H3/t28?,29-,30-/m0/s1
InChIKey PYXCYPVBGCMQDX-WYMOGZRNSA-N
Mol Weight 554.9 g/mol
Molecular Formula C33H62O6
Exact Mass 554.45464 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 38BjRUdY6qV
Name ((4R,5S)-2-[(RS)-4,8-DIMETHYLNONYL]-2-METHYL-1,3-DIOXOLAN-4,5-DIYL)-DIMETHYLOCTANOATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H62O6
InChI InChI=1S/C33H62O6/c1-7-9-11-13-15-22-31(34)36-25-29-30(26-37-32(35)23-16-14-12-10-8-2)39-33(6,38-29)24-18-21-28(5)20-17-19-27(3)4/h27-30H,7-26H2,1-6H3/t28?,29-,30-/m0/s1
InChIKey PYXCYPVBGCMQDX-WYMOGZRNSA-N
Literature Reference Author A.KNIERZINGER,W.WALTHER,B.WEBER,R.K.MUELLER,T.NETSCHER
Literature Reference Citation HELV.CHIM.ACTA,73,1087(1990)
Literature Reference DOI 10.1002/hlca.19900730432
Molecular Weight 554.852 g/mol
Solvent CDCl3
Source File Reference UWED11110