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METHYL-4,5-DIDEHYDRO-JASMONATE

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METHYL-4,5-DIDEHYDRO-JASMONATE
SpectraBase Compound ID 4ZSNOBBPrM2
InChI InChI=1S/C13H18O3/c1-3-4-5-6-11-10(7-8-12(11)14)9-13(15)16-2/h4-5,7-8,10-11H,3,6,9H2,1-2H3/b5-4-/t10-,11-/m1/s1
InChIKey RRZQRPDFHNQSJD-WQMVXFAESA-N
Mol Weight 222.28 g/mol
Molecular Formula C13H18O3
Exact Mass 222.125594 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L1dUybtjXT
Name METHYL-4,5-DIDEHYDRO-JASMONATE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H18O3
InChI InChI=1S/C13H18O3/c1-3-4-5-6-11-10(7-8-12(11)14)9-13(15)16-2/h4-5,7-8,10-11H,3,6,9H2,1-2H3/b5-4-/t10-,11-/m1/s1
InChIKey RRZQRPDFHNQSJD-WQMVXFAESA-N
Literature Reference Author H.KIYOTA,Y.YONETA,T.ORITANI
Literature Reference Citation PHYTOCHEM.,46,983(1997)
Literature Reference DOI 10.1016/s0031-9422(97)00374-9
Molecular Weight 222.284 g/mol
Sample ID 45504
Solvent CDCl3