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OCTADECANOYL_CAFFEATE
SpectraBase Compound ID KYDlFeOgPzb
InChI InChI=1S/C27H44O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-31-27(30)21-19-24-18-20-25(28)26(29)23-24/h18-21,23,28-29H,2-17,22H2,1H3/b21-19+
InChIKey QYVZEPLDLPYECM-XUTLUUPISA-N
Mol Weight 432.6 g/mol
Molecular Formula C27H44O4
Exact Mass 432.32396 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5eF223iPNLe
Name OCTADECANOYL_CAFFEATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H44O4
InChI InChI=1S/C27H44O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-31-27(30)21-19-24-18-20-25(28)26(29)23-24/h18-21,23,28-29H,2-17,22H2,1H3/b21-19+
InChIKey QYVZEPLDLPYECM-XUTLUUPISA-N
Literature Reference Author G.RUBERTO,V.AMICO
Literature Reference Citation PLANTA.MED.,65,678(1999)
Literature Reference DOI 10.1055/s-2006-960850
Molecular Weight 432.644 g/mol
Solvent DMSO-D6:CDCl3
Source File Reference UIAP1333