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(1S,2R)-3-OXO-2-(2'-CIS-PENTENYL)-CYCLOPENTAN-1-ACETATE;(-)-JASMONIC-ACID
SpectraBase Compound ID IXiGJCMfw2r
InChI InChI=1S/C12H18O3/c1-2-3-4-5-10-9(8-12(14)15)6-7-11(10)13/h3-4,9-10H,2,5-8H2,1H3,(H,14,15)/b4-3+/t9-,10-/m0/s1
InChIKey ZNJFBWYDHIGLCU-OHINUGQQSA-N
Mol Weight 210.27 g/mol
Molecular Formula C12H18O3
Exact Mass 210.125594 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9OMjqY9pWvM
Name (1S,2R)-3-OXO-2-(2'-CIS-PENTENYL)-CYCLOPENTAN-1-ACETATE;(-)-JASMONIC-ACID
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H18O3
InChI InChI=1S/C12H18O3/c1-2-3-4-5-10-9(8-12(14)15)6-7-11(10)13/h3-4,9-10H,2,5-8H2,1H3,(H,14,15)/b4-3+/t9-,10-/m0/s1
InChIKey ZNJFBWYDHIGLCU-OHINUGQQSA-N
Literature Reference Author A.HUSAIN,A.AHMAD,P.K.AGRAWAL
Literature Reference Citation J.NAT.PROD.,56,2008(1993)
Literature Reference DOI 10.1021/np50101a025
Molecular Weight 210.273 g/mol
Solvent CDCl3
Source File Reference UWCS5163