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(S)-O-MBE-8-HYDROXY-2-METHYLOCTADECAN-7-ONE
SpectraBase Compound ID 9Z3ri4j4EpI
InChI InChI=1S/C31H56O3/c1-7-8-9-10-11-12-13-14-19-27(26(32)18-16-15-17-23(2)3)33-28-22-24-25-20-21-31(6,29(24)34-28)30(25,4)5/h23-25,27-29H,7-22H2,1-6H3/t24-,25+,27+,28-,29-,31-/m1/s1
InChIKey HHSUZLQCCJOENL-NQCLDDNOSA-N
Mol Weight 476.8 g/mol
Molecular Formula C31H56O3
Exact Mass 476.422946 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1PvlEOmQbiL
Name (S)-O-MBE-8-HYDROXY-2-METHYLOCTADECAN-7-ONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H56O3
InChI InChI=1S/C31H56O3/c1-7-8-9-10-11-12-13-14-19-27(26(32)18-16-15-17-23(2)3)33-28-22-24-25-20-21-31(6,29(24)34-28)30(25,4)5/h23-25,27-29H,7-22H2,1-6H3/t24-,25+,27+,28-,29-,31-/m1/s1
InChIKey HHSUZLQCCJOENL-NQCLDDNOSA-N
Literature Reference Author C.R.NOE,M.KNOLLMUELLER,G.STEINBAUER,E.WAGNER,H.KUERNER,P.ETT MAYER,H.VOELLENKLE
Literature Reference Citation MH.CHEM.,122,299(1991)
Literature Reference DOI 10.1007/BF00810831
Molecular Weight 476.784 g/mol
Solvent CDCl3
Source File Reference UWFP94