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TOXIN-D

View entire compound with spectra: 1 NMR

TOXIN-D
SpectraBase Compound ID 6zPGckWOR25
InChI InChI=1S/C21H30O4/c1-13(12-22)5-4-6-14(2)15-9-10-21(3)17(15)11-16-19(25-21)8-7-18(23)20(16)24/h5,9,14,17-18,22-23H,4,6-8,10-12H2,1-3H3/b13-5+/t14?,17-,18?,21+/m0/s1
InChIKey KOATXBNOVXBDJE-INUGJLMLSA-N
Mol Weight 346.47 g/mol
Molecular Formula C21H30O4
Exact Mass 346.214409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 87yiA5Av1p2
Name TOXIN-D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H30O4
InChI InChI=1S/C21H30O4/c1-13(12-22)5-4-6-14(2)15-9-10-21(3)17(15)11-16-19(25-21)8-7-18(23)20(16)24/h5,9,14,17-18,22-23H,4,6-8,10-12H2,1-3H3/b13-5+/t14?,17-,18?,21+/m0/s1
InChIKey KOATXBNOVXBDJE-INUGJLMLSA-N
Literature Reference Author Y.KONO,J.M.GARDNER,Y.SUZUKI,S.TAKEUCHI
Literature Reference Citation AGR.BIOL.CHEM.,50,1597(1986)
Literature Reference DOI 10.1271/bbb1961.50.1597
Molecular Weight 346.467 g/mol
Solvent CD3OD
Source File Reference UWIR8180