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(3-Z,9-Z,12-Z)-6-ACETOXY-7-CHLORO-PENTADECA-3,9,12-TRIEN-1-YNE
SpectraBase Compound ID KhIp0g9W3ha
InChI InChI=1S/C17H23ClO2/c1-4-6-8-9-10-12-13-16(18)17(20-15(3)19)14-11-7-5-2/h2,6-8,10-12,16-17H,4,9,13-14H2,1,3H3/b8-6-,11-7-,12-10-
InChIKey OIYRZXJDSDRVQP-PFMGRQECSA-N
Mol Weight 294.82 g/mol
Molecular Formula C17H23ClO2
Exact Mass 294.138658 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6dtYdEaiQWG
Name (3-Z,9-Z,12-Z)-6-ACETOXY-7-CHLORO-PENTADECA-3,9,12-TRIEN-1-YNE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H23ClO2
InChI InChI=1S/C17H23ClO2/c1-4-6-8-9-10-12-13-16(18)17(20-15(3)19)14-11-7-5-2/h2,6-8,10-12,16-17H,4,9,13-14H2,1,3H3/b8-6-,11-7-,12-10-
InChIKey OIYRZXJDSDRVQP-PFMGRQECSA-N
Literature Reference Author E.IOANNOU,M.NAPPO,C.AVILA,C.VAGIAS,V.ROUSSIS
Literature Reference Citation J.NAT.PROD.,72,1716(2009)
Literature Reference DOI 10.1021/np900298a
Molecular Weight 294.821 g/mol
Sample ID 33609
Solvent CDCl3