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(4R,9S,13Z,16E)-12-ACETOXY-4-HYDROPEROXY-4,10-SECOSPATA-2,13(15),16-TRIEN-10-ONE

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(4R,9S,13Z,16E)-12-ACETOXY-4-HYDROPEROXY-4,10-SECOSPATA-2,13(15),16-TRIEN-10-ONE
SpectraBase Compound ID 9O2yCtd0zes
InChI InChI=1S/C22H32O6/c1-14(7-6-11-21(4,5)28-26)17-10-12-22(25,13-27-16(3)23)20(17)19-15(2)8-9-18(19)24/h6-9,11,15,17,19-20,25-26H,10,12-13H2,1-5H3/b11-6+,14-7-/t15-,17-,19-,20-,22-/m1/s1
InChIKey CIVYLYHFZUIGLA-WVFGUCIESA-N
Mol Weight 392.5 g/mol
Molecular Formula C22H32O6
Exact Mass 392.219889 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F98RJ44xg5b
Name (4R,9S,13Z,16E)-12-ACETOXY-4-HYDROPEROXY-4,10-SECOSPATA-2,13(15),16-TRIEN-10-ONE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H32O6
InChI InChI=1S/C22H32O6/c1-14(7-6-11-21(4,5)28-26)17-10-12-22(25,13-27-16(3)23)20(17)19-15(2)8-9-18(19)24/h6-9,11,15,17,19-20,25-26H,10,12-13H2,1-5H3/b11-6+,14-7-/t15-,17-,19-,20-,22-/m1/s1
InChIKey CIVYLYHFZUIGLA-WVFGUCIESA-N
Literature Reference Author I.A.VANALTENA,J.MCGIVERN
Literature Reference Citation AUSTR.J.CHEM.,45,541(1992)
Literature Reference DOI 10.1071/ch9920541
Molecular Weight 392.492 g/mol
Solvent CDCl3
Source File Reference UWCS21257