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BUXAMINOL_A
SpectraBase Compound ID 3kQ0NkfsYv0
InChI InChI=1S/C28H48N2O/c1-18(29(6)7)25-23(31)17-28(5)22-12-11-21-19(16-20(22)14-15-27(25,28)4)10-13-24(30(8)9)26(21,2)3/h14,16,18,21-25,31H,10-13,15,17H2,1-9H3/t18?,21-,22-,23-,24+,25+,27-,28+/m1/s1
InChIKey MALAIGCWTXNVKA-HESSZTLLSA-N
Mol Weight 428.7 g/mol
Molecular Formula C28H48N2O
Exact Mass 428.376664 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7dDCmCgiBCJ
Name BUXAMINOL_A
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H48N2O
InChI InChI=1S/C28H48N2O/c1-18(29(6)7)25-23(31)17-28(5)22-12-11-21-19(16-20(22)14-15-27(25,28)4)10-13-24(30(8)9)26(21,2)3/h14,16,18,21-25,31H,10-13,15,17H2,1-9H3/t18?,21-,22-,23-,24+,25+,27-,28+/m1/s1
InChIKey MALAIGCWTXNVKA-HESSZTLLSA-N
Literature Reference Author W.L.MATOCHKO,A.JAMES,C.W.LAM,D.J.KOZERA,A.ATA,R.M.GENGAN
Literature Reference Citation J.NAT.PROD.,73,1858(2010)
Literature Reference DOI 10.1021/np100494u
Molecular Weight 428.702 g/mol
Sample ID 37031
Solvent CDCl3