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(-)-19S-Heyneanine
SpectraBase Compound ID 52SMbSA0CGB
InChI InChI=1S/C21H26N2O3/c1-12(24)16-9-13-10-21(20(25)26-2)18-15(7-8-23(11-13)19(16)21)14-5-3-4-6-17(14)22-18/h3-6,12-13,16,19,22,24H,7-11H2,1-2H3/t12?,13-,16+,19-,21+/m1/s1
InChIKey VGDQBNXQAOYMPS-CVVZXINRSA-N
Mol Weight 354.45 g/mol
Molecular Formula C21H26N2O3
Exact Mass 354.194343 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GBMtKKrbGdH
Name (-)-19S-Heyneanine
CAS Registry Number 76129-69-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H26N2O3
InChI InChI=1S/C21H26N2O3/c1-12(24)16-9-13-10-21(20(25)26-2)18-15(7-8-23(11-13)19(16)21)14-5-3-4-6-17(14)22-18/h3-6,12-13,16,19,22,24H,7-11H2,1-2H3/t12?,13-,16+,19-,21+/m1/s1
InChIKey VGDQBNXQAOYMPS-CVVZXINRSA-N
Instrument Name Jeol PFT-100
Literature Reference P. Perera, G. Samuelsson, Planta Medica 47, 148 (1983).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3