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7-METHYL-7-EPI-JASMONIC-ACID
SpectraBase Compound ID 1rSMRyR7a78
InChI InChI=1S/C13H20O3/c1-3-4-5-8-13(2)10(9-12(15)16)6-7-11(13)14/h4-5,10H,3,6-9H2,1-2H3,(H,15,16)/b5-4-/t10-,13+/m1/s1
InChIKey AIJAJYYQJOVAAV-KXQOAOKJSA-N
Mol Weight 224.3 g/mol
Molecular Formula C13H20O3
Exact Mass 224.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Kq5sTugUalR
Name 7-METHYL-7-EPI-JASMONIC-ACID
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H20O3
InChI InChI=1S/C13H20O3/c1-3-4-5-8-13(2)10(9-12(15)16)6-7-11(13)14/h4-5,10H,3,6-9H2,1-2H3,(H,15,16)/b5-4-/t10-,13+/m1/s1
InChIKey AIJAJYYQJOVAAV-KXQOAOKJSA-N
Literature Reference Author J.L.WARD,M.H.BEALE
Literature Reference Citation J.CHEM.SOC.PERKIN-1,2379(1993)
Literature Reference DOI 10.1039/p19930002379
Molecular Weight 224.300 g/mol
Solvent CDCl3
Source File Reference WANG120