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(2R,5S,1'R,2'E)-2,5-Dihydro-2-(1-hydroxy-hexadec-2'-en-1'-yl)-5-isopropyl-3,6-dimethoxy-pyrazine
SpectraBase Compound ID Ba7HNTAETt3
InChI InChI=1S/C25H46N2O3/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21(28)23-25(30-5)26-22(20(2)3)24(27-23)29-4/h18-23,28H,6-17H2,1-5H3/b19-18+
InChIKey JSOHENFPAPDUHN-VHEBQXMUSA-N
Mol Weight 422.7 g/mol
Molecular Formula C25H46N2O3
Exact Mass 422.350843 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F5AM9DK1XaD
Name (2R,5S,1'R,2'E)-2,5-Dihydro-2-(1-hydroxy-hexadec-2'-en-1'-yl)-5-isopropyl-3,6-dimethoxy-pyrazine
Comments VARIAN VXR 200 OR XL 200 SPECTROMETER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C25H46N2O3
InChI InChI=1S/C25H46N2O3/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21(28)23-25(30-5)26-22(20(2)3)24(27-23)29-4/h18-23,28H,6-17H2,1-5H3/b19-18+
InChIKey JSOHENFPAPDUHN-VHEBQXMUSA-N
Instrument Name see comment
Literature Reference U. Groth, U. Schoellkopf, T. Tiller, Tetrahedron 47, 2835 (1991).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3